#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pt7 s THR 3 N 0.00 1.36 0.32 6.66 -4.23 -1.26 -4.88 115.64 113.62 1pt7 s THR 3 Ca 0.00 -1.91 0.07 0.00 -1.18 0.00 0.00 61.69 58.67 1pt7 s THR 3 Cb 0.00 -1.72 0.31 0.00 1.34 0.00 0.00 72.50 72.43 1pt7 s THR 3 CO 0.00 -0.54 1.83 -0.65 -0.54 0.00 0.00 174.62 174.71 1pt7 h PRO 4 N 3.12 0.75 -0.21 3.99 0.11 -1.92 -2.89 132.00 134.95 1pt7 h PRO 4 Ca -0.39 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 65.62 1pt7 h PRO 4 Cb 1.20 -0.17 -0.03 0.00 0.11 0.00 0.00 31.00 32.11 1pt7 h PRO 4 CO 0.56 0.49 -0.06 1.28 -0.21 0.00 0.00 178.00 180.07 1pt7 n LEU 5 N -4.64 3.55 -4.67 2.35 4.77 0.04 -5.02 117.00 113.37 1pt7 n LEU 5 Ca 0.20 -3.34 -0.59 0.00 -0.03 0.00 0.00 56.01 52.25 1pt7 n LEU 5 Cb 0.50 -0.55 -0.08 0.00 -2.33 0.00 0.00 43.42 40.97 1pt7 n LEU 5 CO 0.26 0.92 1.12 1.67 -1.33 0.00 0.00 177.39 180.04 1pt7 n GLN 6 N -0.95 0.79 0.00 3.23 7.27 -1.09 -1.04 117.38 125.58 1pt7 n GLN 6 Ca 0.24 0.29 0.00 0.00 0.07 0.00 0.00 57.00 57.60 1pt7 n GLN 6 Cb 0.87 -1.90 0.00 0.00 2.41 0.00 0.00 30.24 31.62 1pt7 n GLN 6 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1pt7 n GLY 7 N 3.52 1.18 3.76 1.69 0.00 -1.26 -5.01 105.19 109.07 1pt7 n GLY 7 Ca 0.25 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.87 1pt7 n GLY 7 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1pt7 s ILE 8 N -2.38 4.25 -0.17 -0.61 -1.09 -0.21 -4.95 121.20 116.05 1pt7 s ILE 8 Ca 0.00 1.91 0.00 0.00 -2.23 0.00 0.00 60.65 60.33 1pt7 s ILE 8 Cb 0.00 -4.24 0.01 0.00 -1.58 0.00 0.00 42.46 36.64 1pt7 s ILE 8 CO 0.00 0.49 -0.16 -0.54 -1.23 0.00 0.00 174.94 173.50 1pt7 s LYS 9 N -1.02 3.15 -0.15 2.79 1.02 -1.26 -0.64 119.74 123.63 1pt7 s LYS 9 Ca 0.39 -0.77 -0.02 0.00 0.02 0.00 0.00 55.97 55.59 1pt7 s LYS 9 Cb -0.24 -2.64 -0.02 0.00 -0.52 0.00 0.00 37.83 34.40 1pt7 s LYS 9 CO 0.29 -0.09 -0.07 0.08 -0.92 0.00 0.00 175.35 174.64 1pt7 s VAL 10 N 1.06 3.56 -0.39 3.17 1.01 0.64 -0.27 120.40 129.19 1pt7 s VAL 10 Ca -0.01 -0.48 -0.15 0.00 0.00 0.00 0.00 61.98 61.35 1pt7 s VAL 10 Cb -0.14 -2.54 0.01 0.00 0.00 0.00 0.00 36.38 33.71 1pt7 s VAL 10 CO -0.05 0.50 0.30 -0.76 0.00 0.00 0.00 175.10 175.10 1pt7 s LEU 11 N 0.41 4.90 -0.30 3.92 1.43 0.89 -0.48 118.68 129.45 1pt7 s LEU 11 Ca -0.06 -0.72 0.03 0.00 -1.03 0.00 0.00 54.13 52.34 1pt7 s LEU 11 Cb -0.15 -2.19 0.08 0.00 0.03 0.00 0.00 46.19 43.96 1pt7 s LEU 11 CO 0.04 -0.40 -0.03 -0.62 0.23 0.00 0.00 176.35 175.57 1pt7 s ASP 12 N 1.71 4.64 0.00 2.29 2.15 0.54 -1.34 116.67 126.66 1pt7 s ASP 12 Ca 0.06 -1.69 0.24 0.00 0.43 0.00 0.00 52.55 51.60 1pt7 s ASP 12 Cb -0.18 -1.61 0.79 0.00 -0.30 0.00 0.00 42.92 41.62 1pt7 s ASP 12 CO 0.11 -0.28 1.59 0.49 -0.17 0.00 0.00 175.17 176.90 1pt7 n PHE 13 N 4.39 0.13 -2.65 -5.34 3.72 -0.44 -0.38 117.46 116.90 1pt7 n PHE 13 Ca -0.07 -0.06 -0.33 0.00 -0.05 0.00 0.00 57.45 56.94 1pt7 n PHE 13 Cb 0.42 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 38.91 1pt7 n PHE 13 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 1pt7 s THR 14 N -1.87 4.36 0.33 4.37 -4.23 -1.25 -4.72 115.64 112.64 1pt7 s THR 14 Ca 0.35 1.36 0.03 0.00 -1.18 0.00 0.00 61.69 62.25 1pt7 s THR 14 Cb 0.20 -3.62 -0.04 0.00 1.34 0.00 0.00 72.50 70.38 1pt7 s THR 14 CO 0.30 -0.43 0.13 -0.83 -0.54 0.00 0.00 174.62 173.25 1pt7 s GLY 15 N -2.44 2.19 0.00 3.99 0.00 -1.26 -4.74 107.32 105.06 1pt7 s GLY 15 Ca 0.62 -1.67 0.00 0.00 0.00 0.00 0.00 44.72 43.66 1pt7 s GLY 15 CO 0.20 -1.69 0.00 -0.62 0.00 0.00 0.00 173.10 170.98 1pt7 n VAL 16 N -0.68 0.00 0.00 1.40 0.31 -1.26 -4.40 118.33 113.70 1pt7 n VAL 16 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.31 1pt7 n VAL 16 Cb 0.65 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.58 1pt7 n VAL 16 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 1pt7 n GLN 17 N 12.73 0.00 0.39 5.55 7.27 -1.26 -4.57 117.38 137.49 1pt7 n GLN 17 Ca 0.00 0.00 -0.17 0.00 0.07 0.00 0.00 57.00 56.90 1pt7 n GLN 17 Cb 0.00 -0.62 -0.09 0.00 2.41 0.00 0.00 30.24 31.94 1pt7 n GLN 17 CO 0.00 0.00 0.00 0.66 0.07 0.00 0.00 177.06 177.79 1pt7 h SER 18 N 0.00 -0.84 0.02 1.69 4.64 -1.78 -0.47 113.55 116.81 1pt7 h SER 18 Ca 0.00 0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.33 1pt7 h SER 18 Cb 0.84 0.22 0.00 0.00 -0.31 0.00 0.00 62.40 63.15 1pt7 h SER 18 CO 0.00 -0.53 -0.01 1.23 -0.87 0.00 0.00 176.83 176.65 1pt7 h GLY 19 N -1.13 -0.03 1.12 -0.77 0.00 -1.87 -3.14 103.07 97.24 1pt7 h GLY 19 Ca -0.10 0.01 0.08 0.00 0.00 0.00 0.00 47.33 47.32 1pt7 h GLY 19 CO 0.17 -0.01 0.40 -2.55 0.00 0.00 0.00 176.54 174.54 1pt7 h PRO 20 N -0.30 0.48 -0.63 4.80 0.11 -1.75 -1.77 132.00 132.93 1pt7 h PRO 20 Ca -0.00 -0.03 -0.08 0.00 0.11 0.00 0.00 66.00 66.00 1pt7 h PRO 20 Cb 0.28 -0.11 -0.03 0.00 0.11 0.00 0.00 31.00 31.26 1pt7 h PRO 20 CO 0.01 0.32 0.08 0.66 -0.21 0.00 0.00 178.00 178.85 1pt7 h SER 21 N 0.49 1.01 -0.10 -2.05 4.64 -1.08 0.40 113.55 116.86 1pt7 h SER 21 Ca 0.27 -0.25 -0.00 0.00 -0.47 0.00 0.00 61.79 61.33 1pt7 h SER 21 Cb 0.41 -0.27 -0.00 0.00 -0.31 0.00 0.00 62.40 62.22 1pt7 h SER 21 CO -0.08 1.02 0.05 0.00 -0.87 0.00 0.00 176.83 176.96 1pt7 h THR 23 N 0.06 1.33 -0.68 0.00 1.35 -1.18 -2.22 112.91 111.56 1pt7 h THR 23 Ca 0.04 -2.42 -0.02 0.00 -0.55 0.00 0.00 66.41 63.46 1pt7 h THR 23 Cb 0.10 2.36 -0.03 0.00 -1.73 0.00 0.00 68.15 68.84 1pt7 h THR 23 CO -0.01 0.66 0.35 -0.61 -0.25 0.00 0.00 175.52 175.66 1pt7 h GLN 24 N 0.00 0.97 -0.67 4.72 4.15 -0.88 -0.02 115.11 123.38 1pt7 h GLN 24 Ca -0.01 -0.13 -0.03 0.00 0.77 0.00 0.00 58.65 59.25 1pt7 h GLN 24 Cb 1.31 -0.18 -0.03 0.00 0.21 0.00 0.00 27.48 28.78 1pt7 h GLN 24 CO 0.09 0.75 0.29 0.52 -1.93 0.00 0.00 178.83 178.55 1pt7 h MET 25 N 0.95 0.99 -0.60 1.69 2.86 -1.17 0.20 114.93 119.84 1pt7 h MET 25 Ca 0.24 -0.17 0.06 0.00 -2.06 0.00 0.00 59.70 57.77 1pt7 h MET 25 Cb 0.09 -0.17 -0.05 0.00 0.06 0.00 0.00 31.60 31.53 1pt7 h MET 25 CO -0.03 0.81 0.31 -0.07 1.06 0.00 0.00 176.91 178.99 1pt7 h LEU 26 N 0.94 0.45 -0.37 1.22 3.38 -1.00 -0.23 115.31 119.70 1pt7 h LEU 26 Ca 0.23 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.23 1pt7 h LEU 26 Cb 0.17 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 1pt7 h LEU 26 CO -0.02 0.30 0.23 0.00 0.09 0.00 0.00 178.44 179.03 1pt7 h ALA 27 N 1.32 0.48 -0.06 1.53 0.00 -0.37 -1.72 119.26 120.44 1pt7 h ALA 27 Ca 0.27 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1pt7 h ALA 27 Cb 0.18 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1pt7 h ALA 27 CO -0.18 -0.03 0.04 -1.49 0.00 0.00 0.00 179.25 177.59 1pt7 h TRP 28 N 0.49 0.07 0.00 0.00 6.55 -0.44 -1.18 115.95 121.43 1pt7 h TRP 28 Ca 0.13 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.98 1pt7 h TRP 28 Cb 0.00 -0.02 0.00 0.00 -0.86 0.00 0.00 29.16 28.28 1pt7 h TRP 28 CO -0.04 0.04 0.00 1.19 -1.05 0.00 0.00 178.44 178.59 1pt7 n PHE 29 N -4.53 0.00 0.00 0.49 0.99 -0.15 -4.67 117.46 109.59 1pt7 n PHE 29 Ca -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.43 1pt7 n PHE 29 Cb 0.09 -0.28 0.00 0.00 -1.00 0.00 0.00 39.48 38.29 1pt7 n PHE 29 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1pt7 n GLY 30 N 1.28 0.96 3.80 1.37 0.00 -0.45 -0.78 105.19 111.37 1pt7 n GLY 30 Ca 0.14 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.83 1pt7 n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pt7 s ALA 31 N -2.00 2.77 -0.44 4.61 0.00 -0.71 -4.06 121.76 121.94 1pt7 s ALA 31 Ca 0.00 0.46 -0.21 0.00 0.00 0.00 0.00 51.96 52.20 1pt7 s ALA 31 Cb 0.00 -3.24 0.02 0.00 0.00 0.00 0.00 23.12 19.90 1pt7 s ALA 31 CO 0.00 -0.68 0.68 0.34 0.00 0.00 0.00 175.76 176.10 1pt7 s ASP 32 N -2.57 6.35 -0.36 0.00 2.15 0.19 -4.35 116.67 118.09 1pt7 s ASP 32 Ca 0.65 -0.25 -0.11 0.00 0.43 0.00 0.00 52.55 53.26 1pt7 s ASP 32 Cb -0.16 -2.34 0.02 0.00 -0.30 0.00 0.00 42.92 40.13 1pt7 s ASP 32 CO 0.32 -0.81 0.21 -0.69 -0.17 0.00 0.00 175.17 174.03 1pt7 s VAL 33 N 2.95 4.73 -0.44 1.11 1.01 -1.26 -0.26 120.40 128.24 1pt7 s VAL 33 Ca 0.25 -0.69 -0.17 0.00 0.00 0.00 0.00 61.98 61.38 1pt7 s VAL 33 Cb -0.14 -3.58 0.04 0.00 0.00 0.00 0.00 36.38 32.71 1pt7 s VAL 33 CO 0.20 -0.16 0.42 -0.63 0.00 0.00 0.00 175.10 174.93 1pt7 s ILE 34 N 1.60 5.14 -0.28 2.22 1.01 0.37 -0.83 121.20 130.43 1pt7 s ILE 34 Ca 0.03 -0.63 -0.21 0.00 0.00 0.00 0.00 60.65 59.84 1pt7 s ILE 34 Cb -0.19 -4.07 -0.01 0.00 0.01 0.00 0.00 42.46 38.20 1pt7 s ILE 34 CO 0.07 -0.49 0.67 -0.75 0.00 0.00 0.00 174.94 174.44 1pt7 s LYS 35 N 1.97 4.01 -0.27 2.79 2.20 0.15 -0.33 119.74 130.25 1pt7 s LYS 35 Ca 0.09 0.48 -0.14 0.00 -0.36 0.00 0.00 55.97 56.04 1pt7 s LYS 35 Cb -0.20 -3.69 -0.04 0.00 -1.51 0.00 0.00 37.83 32.39 1pt7 s LYS 35 CO 0.11 -0.52 0.34 0.42 -0.36 0.00 0.00 175.35 175.34 1pt7 s ILE 36 N 2.64 5.20 0.12 5.43 1.01 0.49 -0.88 121.20 135.20 1pt7 s ILE 36 Ca 0.27 0.48 0.07 0.00 0.00 0.00 0.00 60.65 61.47 1pt7 s ILE 36 Cb -0.15 -3.68 -0.04 0.00 0.01 0.00 0.00 42.46 38.61 1pt7 s ILE 36 CO 0.10 0.16 -0.17 -1.61 0.00 0.00 0.00 174.94 173.42 1pt7 s GLU 37 N 2.02 1.09 0.05 2.79 2.02 -0.33 -4.60 118.70 121.74 1pt7 s GLU 37 Ca 0.14 -1.21 -0.31 0.00 0.02 0.00 0.00 54.97 53.61 1pt7 s GLU 37 Cb -0.16 -1.16 -0.07 0.00 0.10 0.00 0.00 34.13 32.85 1pt7 s GLU 37 CO 0.10 0.25 1.46 1.03 0.02 0.00 0.00 175.26 178.12 1pt7 s ARG 38 N -2.31 4.27 0.20 1.61 0.52 -1.26 -1.21 118.95 120.77 1pt7 s ARG 38 Ca 0.08 2.09 -0.32 0.00 -0.52 0.00 0.00 55.73 57.06 1pt7 s ARG 38 Cb -0.08 -3.49 -0.15 0.00 0.52 0.00 0.00 34.95 31.76 1pt7 s ARG 38 CO 0.04 -0.58 1.26 -2.30 0.02 0.00 0.00 175.30 173.74 1pt7 n PRO 39 N 5.03 1.53 -0.73 3.54 -0.02 -1.26 -1.10 135.00 141.99 1pt7 n PRO 39 Ca 0.13 0.54 0.00 0.00 -2.02 0.00 0.00 63.50 62.16 1pt7 n PRO 39 Cb 0.42 -2.10 0.00 0.00 -0.02 0.00 0.00 33.50 31.80 1pt7 n PRO 39 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1pt7 n GLY 40 N 2.06 0.15 1.22 -1.23 0.00 -1.26 -4.67 105.19 101.46 1pt7 n GLY 40 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 1pt7 n GLY 40 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1pt7 n VAL 41 N -2.06 0.30 0.00 1.61 0.31 -0.65 -5.16 118.33 112.69 1pt7 n VAL 41 Ca 0.00 0.10 0.00 0.00 -0.01 0.00 0.00 64.34 64.43 1pt7 n VAL 41 Cb 0.14 -0.97 0.00 0.00 -0.91 0.00 0.00 33.84 32.10 1pt7 n VAL 41 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1pt7 n GLY 42 N 3.09 -1.60 3.64 2.92 0.00 -0.26 -4.84 105.19 108.14 1pt7 n GLY 42 Ca 0.00 -1.54 -0.45 0.00 0.00 0.00 0.00 46.02 44.03 1pt7 n GLY 42 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1pt7 n ASP 43 N -2.04 2.09 0.29 1.61 -0.08 -1.26 -4.76 116.55 112.39 1pt7 n ASP 43 Ca 0.00 1.17 0.15 0.00 -1.51 0.00 0.00 54.79 54.60 1pt7 n ASP 43 Cb 0.00 -1.36 0.89 0.00 2.34 0.00 0.00 41.12 42.99 1pt7 n ASP 43 CO 0.00 0.00 0.00 -0.37 0.12 0.00 0.00 177.20 176.95 1pt7 h VAL 44 N 2.58 0.48 0.00 5.18 -1.51 -1.98 -2.15 116.25 118.84 1pt7 h VAL 44 Ca -0.43 -0.16 0.00 0.00 -1.23 0.00 0.00 66.70 64.88 1pt7 h VAL 44 Cb 1.31 1.11 0.00 0.00 -2.13 0.00 0.00 31.29 31.57 1pt7 h VAL 44 CO 0.68 0.03 0.00 0.71 -1.23 0.00 0.00 177.57 177.76 1pt7 h THR 45 N 0.00 0.00 -0.58 7.19 1.35 -1.92 -1.96 112.91 116.99 1pt7 h THR 45 Ca -0.00 -0.34 0.05 0.00 -0.55 0.00 0.00 66.41 65.57 1pt7 h THR 45 Cb 0.10 1.28 -0.03 0.00 -1.73 0.00 0.00 68.15 67.77 1pt7 h THR 45 CO 0.00 0.00 0.39 0.03 -0.25 0.00 0.00 175.52 175.69 1pt7 h ARG 46 N 0.00 0.60 -0.05 4.72 3.08 -1.71 -3.11 114.38 117.91 1pt7 h ARG 46 Ca 0.00 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.01 1pt7 h ARG 46 Cb 0.36 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.27 1pt7 h ARG 46 CO 0.00 0.40 0.00 -2.39 -1.07 0.00 0.00 179.97 176.91 1pt7 n HIS 47 N -4.47 0.05 -3.73 3.04 1.44 -0.76 -1.54 115.22 109.26 1pt7 n HIS 47 Ca 0.08 -0.07 -0.37 0.00 -2.01 0.00 0.00 57.72 55.35 1pt7 n HIS 47 Cb 0.19 -0.00 -0.06 0.00 0.12 0.00 0.00 29.99 30.23 1pt7 n HIS 47 CO 0.00 0.00 0.00 -0.65 -2.81 0.00 0.00 176.34 172.88 1pt7 s GLN 48 N -0.84 3.70 -1.18 -1.40 -0.21 -1.10 -4.44 119.66 114.18 1pt7 s GLN 48 Ca 0.13 0.04 -0.05 0.00 0.02 0.00 0.00 55.36 55.49 1pt7 s GLN 48 Cb 0.08 -3.24 0.01 0.00 1.00 0.00 0.00 33.01 30.87 1pt7 s GLN 48 CO 0.12 0.67 0.71 1.28 -2.12 0.00 0.00 175.29 175.96 1pt7 n LEU 49 N 2.18 -2.79 -4.76 2.90 4.77 -1.26 -4.62 117.00 113.43 1pt7 n LEU 49 Ca -0.17 -0.33 -0.41 0.00 -0.03 0.00 0.00 56.01 55.07 1pt7 n LEU 49 Cb 0.54 -2.52 -0.02 0.00 -2.33 0.00 0.00 43.42 39.09 1pt7 n LEU 49 CO 0.34 0.35 1.03 -0.13 -1.33 0.00 0.00 177.39 177.65 1pt7 s ARG 50 N -5.75 4.31 -0.04 3.23 0.52 -1.26 -4.66 118.95 115.30 1pt7 s ARG 50 Ca 0.35 2.25 0.20 0.00 -0.52 0.00 0.00 55.73 58.01 1pt7 s ARG 50 Cb -0.16 -3.09 -0.30 0.00 0.52 0.00 0.00 34.95 31.92 1pt7 s ARG 50 CO 0.44 -0.29 0.41 -0.40 0.02 0.00 0.00 175.30 175.48 1pt7 n ASP 51 N 1.48 0.47 -4.08 0.23 3.85 -1.26 -4.89 116.55 112.35 1pt7 n ASP 51 Ca 0.03 0.00 -0.30 0.00 -0.71 0.00 0.00 54.79 53.81 1pt7 n ASP 51 Cb 0.41 1.85 -0.17 0.00 -1.35 0.00 0.00 41.12 41.86 1pt7 n ASP 51 CO 0.00 0.00 0.00 -0.63 -1.01 0.00 0.00 177.20 175.56 1pt7 s ILE 52 N -3.32 1.71 0.35 2.12 1.01 -1.26 -5.12 121.20 116.69 1pt7 s ILE 52 Ca -0.07 -0.75 -0.28 0.00 0.00 0.00 0.00 60.65 59.55 1pt7 s ILE 52 Cb 0.12 -1.55 -0.12 0.00 0.01 0.00 0.00 42.46 40.92 1pt7 s ILE 52 CO 0.82 0.48 1.29 -2.65 0.00 0.00 0.00 174.94 174.89 1pt7 n PRO 53 N 4.35 2.14 -1.08 2.79 -0.02 -1.26 -3.65 135.00 138.28 1pt7 n PRO 53 Ca -0.19 0.75 -0.03 0.00 -2.02 0.00 0.00 63.50 62.01 1pt7 n PRO 53 Cb 0.51 -2.34 -0.01 0.00 -0.02 0.00 0.00 33.50 31.64 1pt7 n PRO 53 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1pt7 n ASP 54 N 0.73 -4.29 -4.30 2.55 8.00 -1.26 -4.99 116.55 112.99 1pt7 n ASP 54 Ca 0.05 0.07 -0.16 0.00 0.71 0.00 0.00 54.79 55.45 1pt7 n ASP 54 Cb 0.36 -2.02 -0.10 0.00 -0.02 0.00 0.00 41.12 39.34 1pt7 n ASP 54 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 1pt7 s ILE 55 N -1.77 0.82 0.23 0.53 -4.36 -1.24 -5.11 121.20 110.29 1pt7 s ILE 55 Ca 0.00 -2.01 -0.32 0.00 -0.26 0.00 0.00 60.65 58.07 1pt7 s ILE 55 Cb 0.00 -2.32 -0.14 0.00 1.25 0.00 0.00 42.46 41.26 1pt7 s ILE 55 CO 0.00 -0.32 1.42 0.47 0.24 0.00 0.00 174.94 176.75 1pt7 n ASP 56 N -0.36 2.74 -4.80 4.36 10.43 -1.26 -4.88 116.55 122.77 1pt7 n ASP 56 Ca -0.05 1.14 -0.32 0.00 2.57 0.00 0.00 54.79 58.13 1pt7 n ASP 56 Cb 0.64 -1.42 0.04 0.00 1.84 0.00 0.00 41.12 42.22 1pt7 n ASP 56 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1pt7 s ALA 57 N 0.05 2.63 0.55 2.24 0.00 -0.59 -4.86 121.76 121.79 1pt7 s ALA 57 Ca 0.70 0.27 0.24 0.00 0.00 0.00 0.00 51.96 53.16 1pt7 s ALA 57 Cb -0.66 -3.22 1.49 0.00 0.00 0.00 0.00 23.12 20.73 1pt7 s ALA 57 CO 0.48 -1.14 2.11 -0.07 0.00 0.00 0.00 175.76 177.14 1pt7 h LEU 58 N -0.26 0.00 -0.66 0.00 3.38 -1.87 -1.42 115.31 114.49 1pt7 h LEU 58 Ca -0.45 0.00 0.08 0.00 0.09 0.00 0.00 57.88 57.60 1pt7 h LEU 58 Cb 1.22 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.90 1pt7 h LEU 58 CO 0.56 0.00 0.31 0.22 0.09 0.00 0.00 178.44 179.63 1pt7 h TYR 59 N 0.00 0.56 0.14 1.13 5.03 -1.82 -1.03 116.97 120.98 1pt7 h TYR 59 Ca 0.09 0.03 -0.01 0.00 2.58 0.00 0.00 58.73 61.42 1pt7 h TYR 59 Cb 0.42 -0.15 0.00 0.00 1.55 0.00 0.00 36.73 38.55 1pt7 h TYR 59 CO 0.00 0.21 -0.07 0.35 -1.32 0.00 0.00 178.16 177.33 1pt7 h PHE 60 N 0.55 -0.17 -0.12 -3.82 3.04 -1.31 -3.33 116.94 111.78 1pt7 h PHE 60 Ca 0.32 -0.00 -0.05 0.00 3.98 0.00 0.00 57.97 62.22 1pt7 h PHE 60 Cb 0.33 0.06 -0.01 0.00 2.56 0.00 0.00 35.95 38.88 1pt7 h PHE 60 CO -0.12 0.30 -0.16 1.79 -2.02 0.00 0.00 178.31 178.10 1pt7 h THR 61 N -0.80 1.18 0.00 4.41 1.35 -1.05 -1.80 112.91 116.20 1pt7 h THR 61 Ca -0.02 -0.81 0.00 0.00 -0.55 0.00 0.00 66.41 65.03 1pt7 h THR 61 Cb 0.54 1.26 0.00 0.00 -1.73 0.00 0.00 68.15 68.22 1pt7 h THR 61 CO 0.03 0.25 0.00 0.23 -0.25 0.00 0.00 175.52 175.78 1pt7 n MET 62 N -4.26 0.05 0.00 4.72 2.81 -0.42 -3.53 117.12 116.48 1pt7 n MET 62 Ca -0.01 0.07 0.00 0.00 -1.81 0.00 0.00 57.70 55.95 1pt7 n MET 62 Cb 0.28 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.29 1pt7 n MET 62 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 1pt7 n LEU 63 N -1.47 1.18 -0.62 4.03 4.77 -0.84 -4.78 117.00 119.26 1pt7 n LEU 63 Ca 0.07 -1.18 0.03 0.00 -0.03 0.00 0.00 56.01 54.90 1pt7 n LEU 63 Cb 0.28 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.41 1pt7 n LEU 63 CO 0.23 0.29 0.27 0.59 -1.33 0.00 0.00 177.39 177.44 1pt7 n ASN 64 N -0.16 0.65 -4.65 -1.43 3.02 -0.74 -4.41 115.26 107.55 1pt7 n ASN 64 Ca 0.00 -2.27 -0.44 0.00 -0.03 0.00 0.00 54.58 51.84 1pt7 n ASN 64 Cb 0.12 -0.27 -0.02 0.00 -0.61 0.00 0.00 39.78 39.01 1pt7 n ASN 64 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1pt7 n SER 65 N -0.20 2.15 0.00 6.41 7.64 -1.23 -2.91 113.62 125.47 1pt7 n SER 65 Ca 0.05 1.18 0.00 0.00 1.01 0.00 0.00 58.87 61.11 1pt7 n SER 65 Cb 0.77 -1.38 0.00 0.00 -1.01 0.00 0.00 64.21 62.59 1pt7 n SER 65 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1pt7 n ASN 66 N 1.31 -0.57 -4.92 6.43 4.13 -0.52 -4.83 115.26 116.30 1pt7 n ASN 66 Ca 0.09 0.00 -0.27 0.00 1.68 0.00 0.00 54.58 56.08 1pt7 n ASN 66 Cb 0.33 -0.60 0.00 0.00 -1.54 0.00 0.00 39.78 37.97 1pt7 n ASN 66 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 1pt7 s LYS 67 N -0.24 3.41 -0.14 3.52 1.02 -1.15 -4.73 119.74 121.43 1pt7 s LYS 67 Ca 0.00 0.06 -0.05 0.00 0.02 0.00 0.00 55.97 56.00 1pt7 s LYS 67 Cb 0.00 -2.41 -0.04 0.00 -0.52 0.00 0.00 37.83 34.87 1pt7 s LYS 67 CO 0.00 -0.24 0.03 1.03 -0.92 0.00 0.00 175.35 175.25 1pt7 s ARG 68 N -4.72 3.58 -0.20 1.68 0.52 -0.01 -4.15 118.95 115.65 1pt7 s ARG 68 Ca 0.48 -0.38 -0.06 0.00 -0.52 0.00 0.00 55.73 55.25 1pt7 s ARG 68 Cb -0.10 -3.03 -0.03 0.00 0.52 0.00 0.00 34.95 32.31 1pt7 s ARG 68 CO 0.43 0.44 0.04 0.45 0.02 0.00 0.00 175.30 176.69 1pt7 s SER 69 N -0.14 5.24 -0.06 0.23 0.15 -1.26 0.31 113.70 118.17 1pt7 s SER 69 Ca 0.06 -0.07 0.06 0.00 0.70 0.00 0.00 55.95 56.70 1pt7 s SER 69 Cb -0.12 -1.90 -0.01 0.00 -1.71 0.00 0.00 66.02 62.27 1pt7 s SER 69 CO 0.02 0.11 -0.24 0.27 1.20 0.00 0.00 173.24 174.59 1pt7 s ILE 70 N 0.77 2.18 -0.13 6.45 -4.36 -0.06 -1.29 121.20 124.77 1pt7 s ILE 70 Ca 0.02 -1.02 -0.26 0.00 -0.26 0.00 0.00 60.65 59.13 1pt7 s ILE 70 Cb -0.14 -1.80 -0.02 0.00 1.25 0.00 0.00 42.46 41.76 1pt7 s ILE 70 CO 0.02 0.57 0.85 -1.61 0.24 0.00 0.00 174.94 175.01 1pt7 s GLU 71 N -0.20 4.36 -0.18 0.37 2.02 -1.26 -1.18 118.70 122.62 1pt7 s GLU 71 Ca -0.02 1.08 -0.09 0.00 0.02 0.00 0.00 54.97 55.96 1pt7 s GLU 71 Cb -0.13 -3.54 0.07 0.00 0.10 0.00 0.00 34.13 30.63 1pt7 s GLU 71 CO 0.03 -0.23 0.43 -1.17 0.02 0.00 0.00 175.26 174.34 1pt7 s LEU 72 N 1.78 -0.28 -0.50 1.80 2.96 -0.35 -4.45 118.68 119.64 1pt7 s LEU 72 Ca 0.41 0.95 -0.14 0.00 -0.22 0.00 0.00 54.13 55.13 1pt7 s LEU 72 Cb -0.17 1.41 0.11 0.00 0.50 0.00 0.00 46.19 48.04 1pt7 s LEU 72 CO 0.16 -0.21 0.43 0.21 -1.32 0.00 0.00 176.35 175.62 1pt7 s ASN 73 N 1.72 6.03 0.49 3.68 3.04 -0.10 -4.43 114.94 125.37 1pt7 s ASN 73 Ca -0.08 -1.70 0.28 0.00 0.04 0.00 0.00 52.86 51.40 1pt7 s ASN 73 Cb -0.09 -2.14 0.86 0.00 -1.54 0.00 0.00 41.25 38.34 1pt7 s ASN 73 CO -0.13 -0.75 1.80 0.71 -3.04 0.00 0.00 177.10 175.68 1pt7 h THR 74 N 5.93 0.04 0.00 -5.21 1.35 -1.86 -2.91 112.91 110.26 1pt7 h THR 74 Ca -0.27 -0.79 -0.01 0.00 -0.55 0.00 0.00 66.41 64.79 1pt7 h THR 74 Cb 1.09 1.76 -0.00 0.00 -1.73 0.00 0.00 68.15 69.27 1pt7 h THR 74 CO 0.95 0.02 -0.04 0.11 -0.25 0.00 0.00 175.52 176.30 1pt7 h LYS 75 N 0.00 0.00 -7.27 4.72 1.79 -1.93 -3.33 116.57 110.55 1pt7 h LYS 75 Ca -0.00 0.00 -0.50 0.00 -2.18 0.00 0.00 60.65 57.97 1pt7 h LYS 75 Cb 0.76 0.00 0.06 0.00 -1.58 0.00 0.00 32.23 31.46 1pt7 h LYS 75 CO 0.00 0.04 0.35 0.95 -1.08 0.00 0.00 179.45 179.71 1pt7 s THR 76 N -4.32 4.69 0.18 -0.16 -4.23 -1.10 -4.95 115.64 105.75 1pt7 s THR 76 Ca -0.04 0.70 -0.06 0.00 -1.18 0.00 0.00 61.69 61.11 1pt7 s THR 76 Cb 0.14 -3.85 -0.04 0.00 1.34 0.00 0.00 72.50 70.09 1pt7 s THR 76 CO 0.53 -1.05 1.51 0.00 -0.54 0.00 0.00 174.62 175.07 1pt7 h ALA 77 N -0.21 0.68 -0.33 3.99 0.00 -1.88 -1.30 119.26 120.21 1pt7 h ALA 77 Ca -0.45 -0.47 -0.09 0.00 0.00 0.00 0.00 54.91 53.90 1pt7 h ALA 77 Cb 1.20 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.87 1pt7 h ALA 77 CO 0.62 0.67 -0.16 0.93 0.00 0.00 0.00 179.25 181.31 1pt7 h GLU 78 N 0.57 0.59 -0.38 0.00 5.08 -1.94 -2.16 114.58 116.35 1pt7 h GLU 78 Ca 0.04 -0.20 -0.11 0.00 -1.00 0.00 0.00 59.36 58.09 1pt7 h GLU 78 Cb 1.01 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.19 1pt7 h GLU 78 CO 0.10 0.73 -0.21 0.78 -1.00 0.00 0.00 179.01 179.41 1pt7 h GLY 79 N 0.97 0.79 0.97 -3.84 0.00 -1.66 -1.83 103.07 98.47 1pt7 h GLY 79 Ca 0.09 -0.66 -0.05 0.00 0.00 0.00 0.00 47.33 46.71 1pt7 h GLY 79 CO 0.04 0.60 0.12 1.70 0.00 0.00 0.00 176.54 179.00 1pt7 h LYS 80 N 0.64 0.77 -0.63 4.80 3.64 -1.10 -0.81 116.57 123.89 1pt7 h LYS 80 Ca 0.09 -0.18 -0.07 0.00 -1.27 0.00 0.00 60.65 59.22 1pt7 h LYS 80 Cb 0.71 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 32.40 1pt7 h LYS 80 CO 0.05 0.75 0.10 1.49 -2.27 0.00 0.00 179.45 179.57 1pt7 h GLU 81 N 0.65 1.02 -0.55 1.90 4.81 -1.14 -0.30 114.58 120.98 1pt7 h GLU 81 Ca 0.15 -0.26 -0.02 0.00 -0.13 0.00 0.00 59.36 59.09 1pt7 h GLU 81 Cb 0.32 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.55 1pt7 h GLU 81 CO 0.00 0.94 0.24 0.28 -0.73 0.00 0.00 179.01 179.75 1pt7 h VAL 82 N 0.96 1.21 -0.49 0.32 2.07 -1.11 -2.67 116.25 116.54 1pt7 h VAL 82 Ca 0.19 -0.62 -0.02 0.00 0.82 0.00 0.00 66.70 67.07 1pt7 h VAL 82 Cb 0.42 0.60 -0.02 0.00 -1.52 0.00 0.00 31.29 30.77 1pt7 h VAL 82 CO 0.01 0.24 0.23 -0.03 0.02 0.00 0.00 177.57 178.04 1pt7 h MET 83 N 0.74 0.71 -0.53 1.57 1.85 -0.62 0.64 114.93 119.28 1pt7 h MET 83 Ca 0.19 -0.11 0.07 0.00 -0.61 0.00 0.00 59.70 59.23 1pt7 h MET 83 Cb 0.15 -0.13 -0.06 0.00 0.43 0.00 0.00 31.60 32.00 1pt7 h MET 83 CO -0.02 0.61 0.23 1.49 -0.40 0.00 0.00 176.91 178.81 1pt7 h GLU 84 N 0.65 0.42 -0.62 0.39 4.81 -0.97 0.22 114.58 119.48 1pt7 h GLU 84 Ca 0.17 -0.03 -0.08 0.00 -0.13 0.00 0.00 59.36 59.29 1pt7 h GLU 84 Cb 0.14 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.40 1pt7 h GLU 84 CO -0.02 0.28 0.07 0.87 -0.73 0.00 0.00 179.01 179.48 1pt7 h LYS 85 N 0.43 1.03 -0.54 1.92 1.57 -1.05 -1.24 116.57 118.68 1pt7 h LYS 85 Ca 0.25 -0.28 -0.01 0.00 -1.87 0.00 0.00 60.65 58.74 1pt7 h LYS 85 Cb 0.24 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.40 1pt7 h LYS 85 CO -0.22 0.96 0.31 -0.07 -0.57 0.00 0.00 179.45 179.86 1pt7 h LEU 86 N 0.96 0.67 -0.80 2.94 3.38 -0.11 -2.76 115.31 119.58 1pt7 h LEU 86 Ca 0.19 -0.08 0.01 0.00 0.09 0.00 0.00 57.88 58.09 1pt7 h LEU 86 Cb 0.46 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 41.00 1pt7 h LEU 86 CO 0.02 0.55 0.53 0.40 0.09 0.00 0.00 178.44 180.03 1pt7 h ILE 87 N 0.73 1.20 -0.33 1.22 2.04 -0.26 -2.14 117.51 119.97 1pt7 h ILE 87 Ca 0.19 -0.37 -0.03 0.00 1.00 0.00 0.00 64.86 65.66 1pt7 h ILE 87 Cb 0.02 0.03 -0.02 0.00 -0.74 0.00 0.00 36.82 36.12 1pt7 h ILE 87 CO -0.03 0.20 0.09 -0.09 0.00 0.00 0.00 178.15 178.32 1pt7 h ARG 88 N 1.07 0.47 -0.01 2.37 2.43 -1.00 -2.55 114.38 117.16 1pt7 h ARG 88 Ca 0.29 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.40 1pt7 h ARG 88 Cb -0.11 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.35 1pt7 h ARG 88 CO -0.07 0.42 -0.51 -0.85 -1.51 0.00 0.00 179.97 177.46 1pt7 n GLU 89 N -4.37 0.65 -3.33 0.20 0.28 -1.02 -4.91 120.64 108.15 1pt7 n GLU 89 Ca 0.02 -0.48 -0.33 0.00 -0.16 0.00 0.00 57.16 56.21 1pt7 n GLU 89 Cb 0.16 -1.49 -0.06 0.00 1.43 0.00 0.00 31.44 31.49 1pt7 n GLU 89 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1pt7 s ALA 90 N -2.67 3.51 -0.10 -1.84 0.00 -0.84 -4.82 121.76 115.01 1pt7 s ALA 90 Ca 0.17 -0.16 -0.00 0.00 0.00 0.00 0.00 51.96 51.97 1pt7 s ALA 90 Cb 0.18 -2.54 -0.25 0.00 0.00 0.00 0.00 23.12 20.51 1pt7 s ALA 90 CO 0.63 0.45 0.45 -0.25 0.00 0.00 0.00 175.76 177.05 1pt7 n ASP 91 N 0.04 1.70 -3.96 0.00 9.92 0.63 -4.60 116.55 120.27 1pt7 n ASP 91 Ca -0.00 0.27 -0.16 0.00 -0.53 0.00 0.00 54.79 54.37 1pt7 n ASP 91 Cb 0.52 -0.58 -0.14 0.00 -0.64 0.00 0.00 41.12 40.28 1pt7 n ASP 91 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 1pt7 s ILE 92 N -2.57 0.42 -0.10 0.53 1.01 -0.85 -0.32 121.20 119.32 1pt7 s ILE 92 Ca -0.17 -0.28 0.03 0.00 0.00 0.00 0.00 60.65 60.23 1pt7 s ILE 92 Cb 0.07 -0.36 0.01 0.00 0.01 0.00 0.00 42.46 42.18 1pt7 s ILE 92 CO 0.79 0.08 -0.21 -0.22 0.00 0.00 0.00 174.94 175.38 1pt7 s LEU 93 N -0.23 1.97 -0.10 2.97 0.20 0.17 -0.08 118.68 123.59 1pt7 s LEU 93 Ca 0.01 -0.50 0.04 0.00 0.69 0.00 0.00 54.13 54.36 1pt7 s LEU 93 Cb -0.03 -1.27 0.00 0.00 -0.43 0.00 0.00 46.19 44.46 1pt7 s LEU 93 CO -0.00 0.11 -0.23 -0.69 -0.29 0.00 0.00 176.35 175.25 1pt7 s VAL 94 N 0.53 2.00 0.02 1.68 1.01 -0.45 -0.01 120.40 125.18 1pt7 s VAL 94 Ca -0.15 -0.98 0.00 0.00 0.00 0.00 0.00 61.98 60.85 1pt7 s VAL 94 Cb -0.17 -1.74 -0.02 0.00 0.00 0.00 0.00 36.38 34.46 1pt7 s VAL 94 CO 0.05 0.55 -0.03 -1.83 0.00 0.00 0.00 175.10 173.84 1pt7 s GLU 95 N 0.41 0.29 -0.26 2.72 4.04 -0.41 -1.32 118.70 124.17 1pt7 s GLU 95 Ca -0.17 -0.51 0.18 0.00 0.04 0.00 0.00 54.97 54.50 1pt7 s GLU 95 Cb -0.18 0.02 0.49 0.00 0.02 0.00 0.00 34.13 34.49 1pt7 s GLU 95 CO 0.08 -0.02 1.14 0.27 -1.84 0.00 0.00 175.26 174.88 1pt7 n ASN 96 N 1.88 2.57 -4.52 0.83 6.94 -1.26 -1.47 115.26 120.22 1pt7 n ASN 96 Ca -0.21 -2.57 -0.29 0.00 -0.02 0.00 0.00 54.58 51.48 1pt7 n ASN 96 Cb 0.56 -0.43 0.14 0.00 -2.36 0.00 0.00 39.78 37.68 1pt7 n ASN 96 CO 0.00 0.00 0.00 -0.36 -1.03 0.00 0.00 177.26 175.87 1pt7 s PHE 97 N -3.60 2.28 0.68 -2.53 2.99 -1.26 -4.91 117.98 111.63 1pt7 s PHE 97 Ca 0.35 0.52 -0.15 0.00 0.00 0.00 0.00 56.93 57.65 1pt7 s PHE 97 Cb 0.35 -3.79 0.01 0.00 0.00 0.00 0.00 43.02 39.59 1pt7 s PHE 97 CO -0.02 -2.20 1.13 -3.38 -0.00 0.00 0.00 175.22 170.75 1pt7 s HIS 98 N -3.72 2.48 0.18 0.36 -3.43 -1.26 -4.88 115.29 105.01 1pt7 s HIS 98 Ca 0.68 1.57 -0.33 0.00 -0.80 0.00 0.00 55.06 56.18 1pt7 s HIS 98 Cb -0.07 -3.24 -0.15 0.00 -1.43 0.00 0.00 32.58 27.68 1pt7 s HIS 98 CO 0.51 -1.91 1.19 -2.30 -2.00 0.00 0.00 174.74 170.23 1pt7 n PRO 99 N -2.49 1.25 -0.82 -0.38 -0.02 -1.26 -2.25 135.00 129.04 1pt7 n PRO 99 Ca 0.11 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 62.04 1pt7 n PRO 99 Cb 0.52 -1.96 0.00 0.00 -0.02 0.00 0.00 33.50 32.03 1pt7 n PRO 99 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1pt7 n GLY 100 N 2.04 0.72 0.13 -1.23 0.00 -1.26 -4.95 105.19 100.64 1pt7 n GLY 100 Ca 0.15 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.04 1pt7 n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pt7 h ALA 101 N 0.00 -0.22 -0.09 4.61 0.00 -1.81 -1.87 119.26 119.88 1pt7 h ALA 101 Ca 0.00 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.75 1pt7 h ALA 101 Cb 0.00 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1pt7 h ALA 101 CO 0.00 -0.46 0.03 0.82 0.00 0.00 0.00 179.25 179.64 1pt7 h ILE 102 N -0.54 0.98 -0.78 0.00 1.08 -1.87 -2.34 117.51 114.04 1pt7 h ILE 102 Ca -0.02 -0.03 0.18 0.00 -0.39 0.00 0.00 64.86 64.60 1pt7 h ILE 102 Cb 0.41 0.90 -0.14 0.00 -3.07 0.00 0.00 36.82 34.92 1pt7 h ILE 102 CO 0.04 0.01 -0.03 0.44 -0.69 0.00 0.00 178.15 177.92 1pt7 h ASP 103 N 0.08 -0.43 1.32 1.72 3.32 -1.58 -2.35 116.42 118.49 1pt7 h ASP 103 Ca 0.04 0.21 -0.01 0.00 0.02 0.00 0.00 57.03 57.29 1pt7 h ASP 103 Cb 0.02 0.38 -0.00 0.00 0.22 0.00 0.00 39.33 39.95 1pt7 h ASP 103 CO -0.04 -0.21 -0.06 0.45 -1.72 0.00 0.00 179.24 177.65 1pt7 h HIS 104 N 0.08 0.00 0.00 4.55 3.86 -0.92 -1.48 115.15 121.23 1pt7 h HIS 104 Ca 0.42 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.63 1pt7 h HIS 104 Cb 0.75 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.22 1pt7 h HIS 104 CO -0.47 0.06 0.00 -1.33 0.86 0.00 0.00 177.93 177.06 1pt7 n MET 105 N -3.15 0.30 -0.01 2.45 2.81 -0.91 -4.86 117.12 113.75 1pt7 n MET 105 Ca 0.02 0.10 0.00 0.00 -1.81 0.00 0.00 57.70 56.01 1pt7 n MET 105 Cb 0.41 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.42 1pt7 n MET 105 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1pt7 n GLY 106 N 0.24 1.00 2.42 3.03 0.00 -0.57 -4.97 105.19 106.33 1pt7 n GLY 106 Ca 0.09 -0.01 -0.27 0.00 0.00 0.00 0.00 46.02 45.84 1pt7 n GLY 106 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1pt7 n PHE 107 N -2.01 -0.35 -0.76 1.61 3.01 -1.05 -5.00 117.46 112.92 1pt7 n PHE 107 Ca 0.00 -3.45 -0.30 0.00 1.01 0.00 0.00 57.45 54.70 1pt7 n PHE 107 Cb 0.00 0.09 0.18 0.00 -0.01 0.00 0.00 39.48 39.73 1pt7 n PHE 107 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 1pt7 s THR 108 N -0.30 2.23 0.26 4.37 -4.23 -1.26 -3.13 115.64 113.57 1pt7 s THR 108 Ca 0.33 0.07 -0.03 0.00 -1.18 0.00 0.00 61.69 60.87 1pt7 s THR 108 Cb 0.05 -2.18 0.26 0.00 1.34 0.00 0.00 72.50 71.96 1pt7 s THR 108 CO -0.18 -0.10 1.88 -0.25 -0.54 0.00 0.00 174.62 175.43 1pt7 h TRP 109 N -1.95 1.15 -0.65 3.99 -0.00 -1.98 0.51 115.95 117.02 1pt7 h TRP 109 Ca -0.48 0.03 -0.06 0.00 -0.00 0.00 0.00 58.89 58.38 1pt7 h TRP 109 Cb 1.28 -0.38 -0.03 0.00 -0.00 0.00 0.00 29.16 30.04 1pt7 h TRP 109 CO 0.45 0.60 0.17 0.93 -0.00 0.00 0.00 178.44 180.60 1pt7 h GLU 110 N 1.14 1.03 -0.36 2.65 3.07 -1.99 -0.74 114.58 119.37 1pt7 h GLU 110 Ca 0.41 -0.24 -0.10 0.00 -0.50 0.00 0.00 59.36 58.93 1pt7 h GLU 110 Cb 0.15 -0.14 -0.01 0.00 -0.84 0.00 0.00 28.75 27.90 1pt7 h GLU 110 CO -0.17 0.92 -0.21 1.25 -1.40 0.00 0.00 179.01 179.40 1pt7 h HIS 111 N 0.95 0.77 -0.49 4.33 2.76 -1.73 -2.20 115.15 119.56 1pt7 h HIS 111 Ca 0.21 -0.16 -0.05 0.00 -2.20 0.00 0.00 60.37 58.16 1pt7 h HIS 111 Cb 0.34 -0.19 -0.02 0.00 1.55 0.00 0.00 27.41 29.09 1pt7 h HIS 111 CO 0.03 0.84 0.12 0.82 -1.30 0.00 0.00 177.93 178.44 1pt7 h ILE 112 N 0.61 1.24 -0.52 6.26 2.04 -0.31 -1.98 117.51 124.85 1pt7 h ILE 112 Ca 0.09 -0.83 -0.02 0.00 1.00 0.00 0.00 64.86 65.10 1pt7 h ILE 112 Cb 0.68 0.85 -0.03 0.00 -0.74 0.00 0.00 36.82 37.59 1pt7 h ILE 112 CO 0.05 0.30 0.24 1.56 0.00 0.00 0.00 178.15 180.30 1pt7 h GLN 113 N 0.67 0.72 -0.51 2.37 4.20 -0.90 -0.03 115.11 121.63 1pt7 h GLN 113 Ca 0.15 -0.09 -0.11 0.00 0.06 0.00 0.00 58.65 58.66 1pt7 h GLN 113 Cb 0.32 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 27.95 1pt7 h GLN 113 CO 0.00 0.57 -0.11 1.49 -0.67 0.00 0.00 178.83 180.11 1pt7 h GLU 114 N 0.72 0.96 -0.17 1.46 4.22 -0.86 -1.81 114.58 119.09 1pt7 h GLU 114 Ca 0.18 -0.35 -0.19 0.00 0.08 0.00 0.00 59.36 59.08 1pt7 h GLU 114 Cb 0.10 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.28 1pt7 h GLU 114 CO -0.02 1.01 -0.66 0.82 -2.18 0.00 0.00 179.01 177.98 1pt7 h ILE 115 N 0.85 1.31 -1.22 2.32 2.04 -0.90 -3.43 117.51 118.48 1pt7 h ILE 115 Ca 0.13 -1.91 -0.15 0.00 1.00 0.00 0.00 64.86 63.93 1pt7 h ILE 115 Cb 0.66 1.88 -0.21 0.00 -0.74 0.00 0.00 36.82 38.40 1pt7 h ILE 115 CO 0.05 0.60 -0.52 0.21 0.00 0.00 0.00 178.15 178.49 1pt7 s ASN 116 N -7.00 -0.91 0.00 1.72 3.84 -0.07 -4.75 114.94 107.78 1pt7 s ASN 116 Ca -0.09 -1.15 0.15 0.00 0.21 0.00 0.00 52.86 51.99 1pt7 s ASN 116 Cb 0.10 1.61 0.73 0.00 -0.55 0.00 0.00 41.25 43.14 1pt7 s ASN 116 CO 0.87 -0.17 1.45 -0.81 -2.79 0.00 0.00 177.10 175.66 1pt7 n PRO 117 N 4.12 0.14 0.00 0.43 -0.04 -0.69 -1.58 135.00 137.37 1pt7 n PRO 117 Ca 0.13 0.18 0.12 0.00 -0.04 0.00 0.00 63.50 63.89 1pt7 n PRO 117 Cb 0.54 -1.50 0.30 0.00 -0.04 0.00 0.00 33.50 32.80 1pt7 n PRO 117 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1pt7 n ARG 118 N -1.37 0.02 -2.44 0.54 1.74 -1.26 -0.90 116.66 112.99 1pt7 n ARG 118 Ca 0.06 0.01 -0.41 0.00 -0.77 0.00 0.00 57.85 56.73 1pt7 n ARG 118 Cb 0.14 -1.51 -0.04 0.00 -1.02 0.00 0.00 32.46 30.03 1pt7 n ARG 118 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1pt7 s LEU 119 N -3.08 4.48 -0.24 0.55 0.20 -0.62 -3.46 118.68 116.51 1pt7 s LEU 119 Ca 0.11 2.18 -0.11 0.00 0.69 0.00 0.00 54.13 57.00 1pt7 s LEU 119 Cb 0.17 -3.61 -0.05 0.00 -0.43 0.00 0.00 46.19 42.28 1pt7 s LEU 119 CO 0.68 -0.29 0.20 -0.63 -0.29 0.00 0.00 176.35 176.02 1pt7 s ILE 120 N -0.26 5.33 -0.30 6.68 1.01 0.57 -3.18 121.20 131.04 1pt7 s ILE 120 Ca 0.50 0.24 -0.08 0.00 0.00 0.00 0.00 60.65 61.31 1pt7 s ILE 120 Cb -0.31 -3.53 -0.00 0.00 0.01 0.00 0.00 42.46 38.62 1pt7 s ILE 120 CO 0.37 0.31 0.12 0.12 0.00 0.00 0.00 174.94 175.86 1pt7 s PHE 121 N 1.23 3.16 -0.19 3.97 5.36 -0.23 -0.65 117.98 130.63 1pt7 s PHE 121 Ca 0.09 -0.72 -0.05 0.00 -0.96 0.00 0.00 56.93 55.28 1pt7 s PHE 121 Cb -0.14 -2.31 -0.03 0.00 -0.34 0.00 0.00 43.02 40.20 1pt7 s PHE 121 CO 0.06 -0.50 0.01 0.20 -1.46 0.00 0.00 175.22 173.53 1pt7 s GLY 122 N 1.57 1.76 -0.07 13.12 0.00 0.99 -0.67 107.32 124.01 1pt7 s GLY 122 Ca 0.04 -0.91 0.02 0.00 0.00 0.00 0.00 44.72 43.87 1pt7 s GLY 122 CO 0.04 0.14 -0.13 -0.45 0.00 0.00 0.00 173.10 172.70 1pt7 s SER 123 N 0.76 1.92 -0.19 1.64 0.15 -0.30 -1.29 113.70 116.38 1pt7 s SER 123 Ca 0.01 -0.33 -0.08 0.00 0.70 0.00 0.00 55.95 56.25 1pt7 s SER 123 Cb -0.14 -0.89 -0.04 0.00 -1.71 0.00 0.00 66.02 63.24 1pt7 s SER 123 CO 0.02 0.04 0.07 -0.63 1.20 0.00 0.00 173.24 173.94 1pt7 s ILE 124 N 0.67 4.76 0.28 6.45 1.01 -0.54 -1.47 121.20 132.35 1pt7 s ILE 124 Ca -0.14 -0.04 0.06 0.00 0.00 0.00 0.00 60.65 60.52 1pt7 s ILE 124 Cb -0.16 -3.16 -0.06 0.00 0.01 0.00 0.00 42.46 39.10 1pt7 s ILE 124 CO 0.04 0.44 -0.03 -0.54 0.00 0.00 0.00 174.94 174.84 1pt7 s LYS 125 N 0.57 1.53 0.12 2.79 -0.14 -0.71 -4.47 119.74 119.43 1pt7 s LYS 125 Ca 0.03 -1.79 -0.13 0.00 -1.36 0.00 0.00 55.97 52.73 1pt7 s LYS 125 Cb -0.13 -1.02 -0.06 0.00 -1.68 0.00 0.00 37.83 34.94 1pt7 s LYS 125 CO 0.01 -0.02 1.45 0.78 -0.76 0.00 0.00 175.35 176.81 1pt7 h GLY 126 N 2.29 0.91 -2.86 -3.33 0.00 -1.88 -1.19 103.07 97.01 1pt7 h GLY 126 Ca -0.40 -0.94 -0.24 0.00 0.00 0.00 0.00 47.33 45.75 1pt7 h GLY 126 CO 0.67 0.84 -0.67 -1.36 0.00 0.00 0.00 176.54 176.03 1pt7 s PHE 127 N -4.38 1.03 0.83 5.60 0.40 -1.26 -1.74 117.98 118.45 1pt7 s PHE 127 Ca -0.12 -1.02 -0.11 0.00 -0.60 0.00 0.00 56.93 55.09 1pt7 s PHE 127 Cb 0.10 -0.59 0.09 0.00 0.51 0.00 0.00 43.02 43.13 1pt7 s PHE 127 CO 0.86 -0.24 1.09 -0.51 0.70 0.00 0.00 175.22 177.12 1pt7 s ASP 128 N -3.10 4.00 0.25 1.36 1.01 -1.26 -4.87 116.67 114.05 1pt7 s ASP 128 Ca 0.19 1.63 -0.05 0.00 0.71 0.00 0.00 52.55 55.03 1pt7 s ASP 128 Cb 0.06 -2.32 0.47 0.00 1.01 0.00 0.00 42.92 42.14 1pt7 s ASP 128 CO 0.00 -2.33 1.69 -0.33 0.21 0.00 0.00 175.17 174.42 1pt7 h GLU 129 N -1.33 0.29 -0.25 8.23 5.08 -2.01 -2.03 114.58 122.55 1pt7 h GLU 129 Ca -0.47 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 57.88 1pt7 h GLU 129 Cb 1.26 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.44 1pt7 h GLU 129 CO 0.53 0.19 0.00 0.00 -1.00 0.00 0.00 179.01 178.73 1pt7 s SER 131 N -1.39 5.74 0.56 0.00 0.15 -0.76 -4.91 113.70 113.09 1pt7 s SER 131 Ca 0.31 2.54 0.37 0.00 0.70 0.00 0.00 55.95 59.87 1pt7 s SER 131 Cb 0.17 -2.62 1.96 0.00 -1.71 0.00 0.00 66.02 63.82 1pt7 s SER 131 CO 0.24 -1.23 2.14 1.55 1.20 0.00 0.00 173.24 177.14 1pt7 h PRO 132 N 1.79 0.00 -0.59 5.44 0.13 -1.93 -2.75 132.00 134.09 1pt7 h PRO 132 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 1pt7 h PRO 132 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 1pt7 h PRO 132 CO 0.59 0.00 0.00 0.66 -0.23 0.00 0.00 178.00 179.02 1pt7 n TYR 133 N -2.86 2.07 0.27 1.56 4.02 -1.26 -4.70 117.16 116.25 1pt7 n TYR 133 Ca -0.02 -0.72 0.13 0.00 -0.01 0.00 0.00 57.90 57.28 1pt7 n TYR 133 Cb 0.10 -0.50 0.82 0.00 -0.02 0.00 0.00 39.34 39.74 1pt7 n TYR 133 CO 0.00 0.00 0.00 -0.24 -1.01 0.00 0.00 176.86 175.61 1pt7 h VAL 134 N 4.04 0.67 -0.37 -0.72 3.04 -1.78 0.06 116.25 121.18 1pt7 h VAL 134 Ca 0.00 0.00 -0.10 0.00 -1.01 0.00 0.00 66.70 65.59 1pt7 h VAL 134 Cb 1.96 0.98 -0.06 0.00 -2.01 0.00 0.00 31.29 32.16 1pt7 h VAL 134 CO 0.48 0.00 0.03 0.59 -1.01 0.00 0.00 177.57 177.66 1pt7 n ASN 135 N -4.06 3.48 -4.78 3.17 3.02 -1.26 -4.81 115.26 110.01 1pt7 n ASN 135 Ca -0.02 -3.33 -0.37 0.00 -0.03 0.00 0.00 54.58 50.83 1pt7 n ASN 135 Cb 0.11 -0.61 -0.04 0.00 -0.61 0.00 0.00 39.78 38.63 1pt7 n ASN 135 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1pt7 s VAL 136 N -3.01 3.71 -0.34 2.41 1.01 0.00 -5.01 120.40 119.17 1pt7 s VAL 136 Ca 0.45 1.32 -0.17 0.00 0.00 0.00 0.00 61.98 63.58 1pt7 s VAL 136 Cb 0.38 -3.69 -0.01 0.00 0.00 0.00 0.00 36.38 33.06 1pt7 s VAL 136 CO 0.06 0.02 0.45 -1.59 0.00 0.00 0.00 175.10 174.04 1pt7 s LYS 137 N -2.46 3.62 -0.25 2.72 0.00 -1.26 -4.83 119.74 117.28 1pt7 s LYS 137 Ca 0.57 -0.24 -0.10 0.00 0.00 0.00 0.00 55.97 56.20 1pt7 s LYS 137 Cb -0.22 -3.80 -0.05 0.00 0.00 0.00 0.00 37.83 33.76 1pt7 s LYS 137 CO 0.28 -0.58 0.15 0.00 0.00 0.00 0.00 175.35 175.20 1pt7 s ALA 138 N 2.24 3.49 0.41 0.59 0.00 -1.26 -5.02 121.76 122.21 1pt7 s ALA 138 Ca 0.16 -0.99 0.08 0.00 0.00 0.00 0.00 51.96 51.21 1pt7 s ALA 138 Cb -0.16 -2.31 0.01 0.00 0.00 0.00 0.00 23.12 20.66 1pt7 s ALA 138 CO 0.12 -0.34 0.55 0.71 0.00 0.00 0.00 175.76 176.80 1pt7 s TYR 139 N 1.36 2.85 0.08 0.00 1.51 -1.26 -4.92 117.35 116.97 1pt7 s TYR 139 Ca 0.07 -0.38 -0.15 0.00 -1.01 0.00 0.00 57.07 55.60 1pt7 s TYR 139 Cb -0.15 -2.33 -0.03 0.00 -0.11 0.00 0.00 41.96 39.34 1pt7 s TYR 139 CO 0.07 -0.36 0.99 -1.91 -1.11 0.00 0.00 175.55 173.22 1pt7 n GLU 140 N -1.82 -0.22 0.21 -0.62 4.07 -1.26 -1.80 120.64 119.21 1pt7 n GLU 140 Ca 0.07 0.98 0.10 0.00 -0.06 0.00 0.00 57.16 58.25 1pt7 n GLU 140 Cb 0.59 -1.44 0.27 0.00 -0.06 0.00 0.00 31.44 30.79 1pt7 n GLU 140 CO 0.00 0.00 0.00 -0.91 -0.06 0.00 0.00 177.13 176.16 1pt7 h ASN 141 N 0.00 0.00 -0.04 4.31 2.35 -1.97 -2.14 115.58 118.09 1pt7 h ASN 141 Ca 0.08 0.00 0.02 0.00 -0.55 0.00 0.00 56.30 55.84 1pt7 h ASN 141 Cb 0.20 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.56 1pt7 h ASN 141 CO -0.46 0.17 -0.05 0.58 -1.65 0.00 0.00 177.43 176.02 1pt7 h VAL 142 N 0.00 0.85 -0.69 2.81 2.07 -1.74 -1.73 116.25 117.82 1pt7 h VAL 142 Ca -0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1pt7 h VAL 142 Cb 0.98 0.85 -0.03 0.00 -1.52 0.00 0.00 31.29 31.57 1pt7 h VAL 142 CO 0.02 0.00 0.44 0.00 0.02 0.00 0.00 177.57 178.05 1pt7 h ALA 143 N 0.96 0.87 -0.84 1.67 0.00 -1.15 -1.51 119.26 119.26 1pt7 h ALA 143 Ca 0.03 -0.06 0.10 0.00 0.00 0.00 0.00 54.91 54.99 1pt7 h ALA 143 Cb 0.12 -0.28 -0.06 0.00 0.00 0.00 0.00 17.79 17.58 1pt7 h ALA 143 CO -0.08 0.31 0.54 1.96 0.00 0.00 0.00 179.25 181.98 1pt7 h GLN 144 N 0.93 0.75 -0.17 0.00 4.20 -1.24 -0.13 115.11 119.46 1pt7 h GLN 144 Ca 0.25 -0.05 -0.05 0.00 0.06 0.00 0.00 58.65 58.87 1pt7 h GLN 144 Cb -0.08 -0.17 -0.00 0.00 0.30 0.00 0.00 27.48 27.52 1pt7 h GLN 144 CO -0.05 0.50 -0.08 0.00 -0.67 0.00 0.00 178.83 178.53 1pt7 h ALA 145 N 1.58 0.23 0.00 3.87 0.00 -1.00 -2.41 119.26 121.54 1pt7 h ALA 145 Ca 0.39 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1pt7 h ALA 145 Cb 0.46 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 1pt7 h ALA 145 CO -0.16 0.04 -0.06 0.00 0.00 0.00 0.00 179.25 179.07 1pt7 h ALA 146 N 0.68 1.00 -0.03 0.00 0.00 -0.83 -3.30 119.26 116.79 1pt7 h ALA 146 Ca 0.04 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1pt7 h ALA 146 Cb 0.55 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1pt7 h ALA 146 CO 0.02 0.08 -0.01 0.41 0.00 0.00 0.00 179.25 179.75 1pt7 n GLY 147 N 0.18 0.91 0.00 0.00 0.00 -0.10 -4.95 105.19 101.22 1pt7 n GLY 147 Ca 0.01 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.36 1pt7 n GLY 147 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pt7 n GLY 148 N 1.31 2.31 0.08 -0.02 0.00 -1.23 -3.46 105.19 104.17 1pt7 n GLY 148 Ca 0.13 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.02 1pt7 n GLY 148 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pt7 h ALA 149 N 0.00 0.05 -0.79 4.61 0.00 -1.79 -2.91 119.26 118.43 1pt7 h ALA 149 Ca 0.00 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.58 1pt7 h ALA 149 Cb 0.00 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 1pt7 h ALA 149 CO 0.00 -0.12 0.41 0.00 0.00 0.00 0.00 179.25 179.54 1pt7 h ALA 150 N 0.45 1.24 -0.46 0.00 0.00 -1.60 -0.89 119.26 117.99 1pt7 h ALA 150 Ca 0.00 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 1pt7 h ALA 150 Cb 0.64 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1pt7 h ALA 150 CO 0.01 0.60 0.27 1.03 0.00 0.00 0.00 179.25 181.17 1pt7 h SER 151 N 1.11 0.55 -0.05 0.00 0.87 -1.81 -2.91 113.55 111.31 1pt7 h SER 151 Ca 0.27 -0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.81 1pt7 h SER 151 Cb 0.06 -0.14 0.00 0.00 -0.44 0.00 0.00 62.40 61.89 1pt7 h SER 151 CO -0.04 0.43 0.00 0.35 -0.53 0.00 0.00 176.83 177.04 1pt7 n THR 152 N -4.44 0.05 -4.49 2.23 -2.24 -0.86 -4.22 114.28 100.32 1pt7 n THR 152 Ca 0.04 -0.53 -0.34 0.00 -2.27 0.00 0.00 64.05 60.95 1pt7 n THR 152 Cb 0.08 1.31 -0.10 0.00 -2.10 0.00 0.00 70.33 69.51 1pt7 n THR 152 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1pt7 s THR 153 N -1.39 4.01 0.00 4.28 2.01 -0.40 -4.37 115.64 119.79 1pt7 s THR 153 Ca 0.21 -0.36 0.00 0.00 0.31 0.00 0.00 61.69 61.85 1pt7 s THR 153 Cb 0.14 -2.67 0.00 0.00 0.01 0.00 0.00 72.50 69.98 1pt7 s THR 153 CO 0.21 0.59 0.00 0.61 -0.69 0.00 0.00 174.62 175.35 1pt7 n GLY 154 N 2.30 -0.16 3.73 4.40 0.00 -1.26 -1.83 105.19 112.37 1pt7 n GLY 154 Ca -0.18 -2.13 -0.28 0.00 0.00 0.00 0.00 46.02 43.43 1pt7 n GLY 154 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1pt7 s PHE 155 N 0.00 3.03 0.48 1.61 0.40 -1.26 -0.19 117.98 122.05 1pt7 s PHE 155 Ca 0.00 -0.04 0.16 0.00 -0.60 0.00 0.00 56.93 56.45 1pt7 s PHE 155 Cb 0.00 -1.50 1.14 0.00 0.51 0.00 0.00 43.02 43.17 1pt7 s PHE 155 CO 0.00 0.51 2.07 0.11 0.70 0.00 0.00 175.22 178.61 1pt7 h TRP 156 N 2.91 0.00 -0.55 0.36 0.09 -1.94 -2.06 115.95 114.76 1pt7 h TRP 156 Ca -0.47 0.00 -0.12 0.00 0.09 0.00 0.00 58.89 58.39 1pt7 h TRP 156 Cb 1.18 0.00 -0.07 0.00 0.08 0.00 0.00 29.16 30.35 1pt7 h TRP 156 CO 0.60 0.10 0.12 -0.40 0.09 0.00 0.00 178.44 178.95 1pt7 n ASP 157 N -4.40 4.56 -3.63 0.11 5.75 -1.26 -4.93 116.55 112.75 1pt7 n ASP 157 Ca -0.03 -3.17 -0.23 0.00 -0.01 0.00 0.00 54.79 51.35 1pt7 n ASP 157 Cb 0.17 -0.68 -0.06 0.00 -1.03 0.00 0.00 41.12 39.52 1pt7 n ASP 157 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1pt7 n GLY 158 N -0.19 3.34 3.79 6.12 0.00 -0.77 -5.16 105.19 112.31 1pt7 n GLY 158 Ca 0.33 -2.10 -0.30 0.00 0.00 0.00 0.00 46.02 43.95 1pt7 n GLY 158 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1pt7 s PRO 159 N -3.39 2.14 0.26 1.61 0.04 -1.26 -4.78 135.00 129.62 1pt7 s PRO 159 Ca 0.18 0.82 -0.28 0.00 0.04 0.00 0.00 61.00 61.76 1pt7 s PRO 159 Cb 0.01 -1.91 -0.15 0.00 0.04 0.00 0.00 34.50 32.49 1pt7 s PRO 159 CO 0.13 -1.63 0.86 -2.30 0.04 0.00 0.00 177.00 174.10 1pt7 n PRO 160 N -3.47 0.92 -4.84 0.56 -0.02 -1.26 -4.48 135.00 122.41 1pt7 n PRO 160 Ca 0.07 0.32 -0.25 0.00 -2.02 0.00 0.00 63.50 61.63 1pt7 n PRO 160 Cb 0.55 -1.58 -0.16 0.00 -0.02 0.00 0.00 33.50 32.29 1pt7 n PRO 160 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1pt7 s LEU 161 N 1.25 2.01 0.48 2.45 1.98 -0.76 -5.01 118.68 121.08 1pt7 s LEU 161 Ca 0.61 -0.33 -0.14 0.00 -2.89 0.00 0.00 54.13 51.38 1pt7 s LEU 161 Cb -0.78 -0.92 -0.07 0.00 0.66 0.00 0.00 46.19 45.08 1pt7 s LEU 161 CO 0.59 0.20 0.90 0.68 -1.89 0.00 0.00 176.35 176.83 1pt7 s VAL 162 N -0.32 4.65 0.07 1.68 -7.23 -1.26 -4.18 120.40 113.82 1pt7 s VAL 162 Ca 0.05 0.94 -0.06 0.00 -1.81 0.00 0.00 61.98 61.09 1pt7 s VAL 162 Cb -0.08 -3.74 -0.05 0.00 0.56 0.00 0.00 36.38 33.07 1pt7 s VAL 162 CO -0.00 -0.66 0.34 -0.44 -0.31 0.00 0.00 175.10 174.02 1pt7 s SER 163 N -3.21 6.52 0.35 4.85 0.01 -1.26 -4.99 113.70 115.96 1pt7 s SER 163 Ca 0.55 0.61 0.04 0.00 1.31 0.00 0.00 55.95 58.47 1pt7 s SER 163 Cb -0.10 -2.11 0.63 0.00 0.21 0.00 0.00 66.02 64.65 1pt7 s SER 163 CO 0.33 0.16 1.92 0.00 0.41 0.00 0.00 173.24 176.06 1pt7 h ALA 164 N 3.48 1.43 -2.92 1.44 0.00 -2.06 -3.43 119.26 117.21 1pt7 h ALA 164 Ca -0.48 -0.15 -0.53 0.00 0.00 0.00 0.00 54.91 53.74 1pt7 h ALA 164 Cb 1.18 -0.17 0.09 0.00 0.00 0.00 0.00 17.79 18.90 1pt7 h ALA 164 CO 0.69 0.42 0.70 0.00 0.00 0.00 0.00 179.25 181.06 1pt7 s ALA 165 N -5.16 3.46 -1.37 0.00 0.00 -1.26 -4.86 121.76 112.57 1pt7 s ALA 165 Ca -0.08 1.41 -0.14 0.00 0.00 0.00 0.00 51.96 53.15 1pt7 s ALA 165 Cb 0.16 -3.55 0.08 0.00 0.00 0.00 0.00 23.12 19.81 1pt7 s ALA 165 CO 0.76 -0.91 1.97 0.00 0.00 0.00 0.00 175.76 177.59 1pt7 n ALA 166 N 0.44 4.87 0.08 0.00 0.00 -1.26 -4.69 120.51 119.95 1pt7 n ALA 166 Ca 0.02 -3.98 -0.01 0.00 0.00 0.00 0.00 53.44 49.46 1pt7 n ALA 166 Cb 0.41 -3.41 0.27 0.00 0.00 0.00 0.00 19.45 16.72 1pt7 n ALA 166 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1pt7 h LEU 167 N 10.22 0.30 0.02 0.00 3.38 -1.89 -0.63 115.31 126.72 1pt7 h LEU 167 Ca 0.49 -0.10 -0.25 0.00 0.09 0.00 0.00 57.88 58.11 1pt7 h LEU 167 Cb 0.72 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.35 1pt7 h LEU 167 CO 1.68 0.57 -1.31 1.23 0.09 0.00 0.00 178.44 180.70 1pt7 h GLY 168 N 1.01 0.06 0.00 0.83 0.00 -1.84 -3.36 103.07 99.77 1pt7 h GLY 168 Ca 0.04 -0.14 0.00 0.00 0.00 0.00 0.00 47.33 47.23 1pt7 h GLY 168 CO 0.04 0.13 0.00 1.22 0.00 0.00 0.00 176.54 177.93 1pt7 n ASP 169 N -3.28 0.00 -0.38 0.19 9.92 -1.14 -4.00 116.55 117.86 1pt7 n ASP 169 Ca -0.08 0.00 -0.01 0.00 -0.53 0.00 0.00 54.79 54.17 1pt7 n ASP 169 Cb 0.99 0.00 0.12 0.00 -0.64 0.00 0.00 41.12 41.60 1pt7 n ASP 169 CO 0.00 0.00 0.00 0.28 0.13 0.00 0.00 177.20 177.61 1pt7 h SER 170 N 0.00 1.13 -0.75 -2.24 0.02 -1.76 -1.13 113.55 108.83 1pt7 h SER 170 Ca 0.00 -0.02 0.05 0.00 -0.84 0.00 0.00 61.79 60.98 1pt7 h SER 170 Cb 0.00 -0.27 -0.05 0.00 0.14 0.00 0.00 62.40 62.22 1pt7 h SER 170 CO 0.00 0.80 0.45 -1.13 -1.14 0.00 0.00 176.83 175.81 1pt7 h ASN 171 N 1.32 0.72 -0.64 3.07 -1.24 -1.32 -0.73 115.58 116.75 1pt7 h ASN 171 Ca 0.38 0.01 0.01 0.00 0.71 0.00 0.00 56.30 57.41 1pt7 h ASN 171 Cb -0.09 -0.14 -0.03 0.00 0.73 0.00 0.00 38.32 38.80 1pt7 h ASN 171 CO -0.10 0.47 0.42 0.74 -1.29 0.00 0.00 177.43 177.67 1pt7 h THR 172 N 0.85 1.16 -0.85 -3.57 2.02 -1.38 -1.08 112.91 110.06 1pt7 h THR 172 Ca 0.32 -0.29 0.08 0.00 0.77 0.00 0.00 66.41 67.28 1pt7 h THR 172 Cb 0.12 0.23 -0.07 0.00 -1.74 0.00 0.00 68.15 66.69 1pt7 h THR 172 CO -0.15 0.16 0.52 1.23 0.37 0.00 0.00 175.52 177.64 1pt7 h GLY 173 N 0.86 1.31 1.50 2.16 0.00 -0.68 1.00 103.07 109.21 1pt7 h GLY 173 Ca 0.23 -0.36 -0.14 0.00 0.00 0.00 0.00 47.33 47.06 1pt7 h GLY 173 CO -0.05 0.20 -0.46 -0.33 0.00 0.00 0.00 176.54 175.91 1pt7 h MET 174 N 0.90 0.54 -0.45 4.80 2.07 -0.64 -0.24 114.93 121.91 1pt7 h MET 174 Ca 0.39 -0.30 -0.14 0.00 -2.07 0.00 0.00 59.70 57.59 1pt7 h MET 174 Cb 0.27 0.02 -0.01 0.00 -1.87 0.00 0.00 31.60 30.00 1pt7 h MET 174 CO -0.21 0.89 -0.25 0.45 1.07 0.00 0.00 176.91 178.86 1pt7 h HIS 175 N 0.44 1.13 -0.46 -0.22 3.86 -0.71 -1.83 115.15 117.35 1pt7 h HIS 175 Ca 0.03 -0.29 -0.01 0.00 -1.16 0.00 0.00 60.37 58.94 1pt7 h HIS 175 Cb 0.97 -0.26 -0.02 0.00 1.06 0.00 0.00 27.41 29.16 1pt7 h HIS 175 CO 0.04 1.12 0.26 1.25 0.86 0.00 0.00 177.93 181.45 1pt7 h LEU 176 N 0.82 0.58 -0.77 2.43 5.85 -0.56 -2.07 115.31 121.58 1pt7 h LEU 176 Ca 0.10 -0.08 0.11 0.00 0.84 0.00 0.00 57.88 58.84 1pt7 h LEU 176 Cb 0.84 -0.15 -0.08 0.00 0.37 0.00 0.00 40.66 41.64 1pt7 h LEU 176 CO 0.07 0.49 0.40 0.25 -0.34 0.00 0.00 178.44 179.32 1pt7 h LEU 177 N 0.61 0.51 -0.58 2.25 5.85 -0.89 0.12 115.31 123.18 1pt7 h LEU 177 Ca 0.16 0.07 0.06 0.00 0.84 0.00 0.00 57.88 59.01 1pt7 h LEU 177 Cb 0.04 -0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.00 1pt7 h LEU 177 CO -0.03 0.27 0.29 0.40 -0.34 0.00 0.00 178.44 179.03 1pt7 h ILE 178 N 0.64 0.93 -0.68 4.05 2.04 -0.93 -0.76 117.51 122.80 1pt7 h ILE 178 Ca 0.39 -0.19 -0.05 0.00 1.00 0.00 0.00 64.86 66.01 1pt7 h ILE 178 Cb 0.45 0.34 -0.03 0.00 -0.74 0.00 0.00 36.82 36.84 1pt7 h ILE 178 CO -0.30 0.10 0.23 1.23 0.00 0.00 0.00 178.15 179.41 1pt7 h GLY 179 N 0.55 1.12 0.95 5.37 0.00 -0.40 -0.32 103.07 110.34 1pt7 h GLY 179 Ca 0.26 -0.65 -0.04 0.00 0.00 0.00 0.00 47.33 46.90 1pt7 h GLY 179 CO -0.19 0.61 0.12 1.41 0.00 0.00 0.00 176.54 178.49 1pt7 h LEU 180 N 0.98 0.67 -0.41 3.11 3.38 -0.56 0.14 115.31 122.62 1pt7 h LEU 180 Ca 0.22 -0.22 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 1pt7 h LEU 180 Cb 0.27 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 1pt7 h LEU 180 CO -0.01 0.71 0.17 -0.07 0.09 0.00 0.00 178.44 179.33 1pt7 h LEU 181 N 0.59 0.57 -1.05 1.67 3.38 -0.93 -0.39 115.31 119.14 1pt7 h LEU 181 Ca 0.14 -0.16 0.01 0.00 0.09 0.00 0.00 57.88 57.96 1pt7 h LEU 181 Cb 0.30 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 40.85 1pt7 h LEU 181 CO -0.00 0.57 0.61 0.00 0.09 0.00 0.00 178.44 179.71 1pt7 h ALA 182 N 1.01 1.31 -0.23 1.53 0.00 -0.95 -1.44 119.26 120.49 1pt7 h ALA 182 Ca 0.14 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.87 1pt7 h ALA 182 Cb 0.18 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 1pt7 h ALA 182 CO -0.01 0.63 -0.30 0.00 0.00 0.00 0.00 179.25 179.57 1pt7 h ALA 183 N 1.39 1.05 -0.59 0.00 0.00 -0.17 0.64 119.26 121.60 1pt7 h ALA 183 Ca 0.34 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1pt7 h ALA 183 Cb -0.13 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 1pt7 h ALA 183 CO -0.07 0.58 0.31 -0.07 0.00 0.00 0.00 179.25 180.00 1pt7 h LEU 184 N 0.40 0.74 -0.70 0.00 3.38 -0.61 0.12 115.31 118.63 1pt7 h LEU 184 Ca 0.05 -0.10 -0.04 0.00 0.09 0.00 0.00 57.88 57.88 1pt7 h LEU 184 Cb 0.73 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.26 1pt7 h LEU 184 CO 0.06 0.63 0.28 -0.07 0.09 0.00 0.00 178.44 179.43 1pt7 h LEU 185 N 0.79 0.98 -0.74 1.67 3.38 -0.96 -2.69 115.31 117.75 1pt7 h LEU 185 Ca 0.21 -0.17 -0.10 0.00 0.09 0.00 0.00 57.88 57.90 1pt7 h LEU 185 Cb 0.06 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 1pt7 h LEU 185 CO -0.03 0.88 -0.16 -0.74 0.09 0.00 0.00 178.44 178.49 1pt7 h HIS 186 N 1.01 0.89 -0.70 1.13 2.76 -0.59 -3.05 115.15 116.59 1pt7 h HIS 186 Ca 0.23 -0.18 -0.00 0.00 -2.20 0.00 0.00 60.37 58.22 1pt7 h HIS 186 Cb 0.22 -0.22 -0.03 0.00 1.55 0.00 0.00 27.41 28.92 1pt7 h HIS 186 CO 0.02 0.90 0.43 -0.09 -1.30 0.00 0.00 177.93 177.88 1pt7 h ARG 187 N 0.71 0.95 -0.44 5.26 2.43 -0.44 -0.73 114.38 122.12 1pt7 h ARG 187 Ca 0.11 -0.08 0.13 0.00 -0.81 0.00 0.00 59.98 59.33 1pt7 h ARG 187 Cb 0.66 -0.20 -0.02 0.00 -0.42 0.00 0.00 29.97 29.99 1pt7 h ARG 187 CO 0.05 0.66 0.39 0.93 -1.51 0.00 0.00 179.97 180.49 1pt7 h GLU 188 N 0.97 0.00 0.05 0.20 5.08 -1.39 0.22 114.58 119.72 1pt7 h GLU 188 Ca 0.25 0.00 -0.35 0.00 -1.00 0.00 0.00 59.36 58.27 1pt7 h GLU 188 Cb -0.04 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.17 1pt7 h GLU 188 CO -0.05 0.00 -1.97 1.63 -1.00 0.00 0.00 179.01 177.62 1pt7 n LYS 189 N -4.01 0.67 0.08 2.33 5.02 -0.36 -4.50 118.16 117.39 1pt7 n LYS 189 Ca 0.08 0.32 0.12 0.00 -2.02 0.00 0.00 58.31 56.81 1pt7 n LYS 189 Cb 0.58 -1.66 0.19 0.00 -0.02 0.00 0.00 35.03 34.13 1pt7 n LYS 189 CO 0.00 0.00 0.00 1.79 -0.52 0.00 0.00 177.40 178.67 1pt7 h THR 190 N -0.35 0.00 0.00 -0.18 1.35 -1.24 -3.47 112.91 109.01 1pt7 h THR 190 Ca -0.47 -0.57 0.00 0.00 -0.55 0.00 0.00 66.41 64.82 1pt7 h THR 190 Cb 1.77 1.23 0.00 0.00 -1.73 0.00 0.00 68.15 69.42 1pt7 h THR 190 CO -0.09 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.79 1pt7 n GLY 191 N 1.30 0.25 3.28 5.82 0.00 0.77 -4.99 105.19 111.61 1pt7 n GLY 191 Ca 0.03 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.84 1pt7 n GLY 191 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1pt7 s ARG 192 N -1.06 1.11 0.73 1.61 0.52 -1.25 -4.65 118.95 115.96 1pt7 s ARG 192 Ca 0.00 -1.24 -0.06 0.00 -0.52 0.00 0.00 55.73 53.91 1pt7 s ARG 192 Cb 0.00 -1.19 0.16 0.00 0.52 0.00 0.00 34.95 34.43 1pt7 s ARG 192 CO 0.00 0.25 1.00 0.41 0.02 0.00 0.00 175.30 176.98 1pt7 n GLY 193 N 0.72 -0.17 3.82 -3.53 0.00 -0.08 -4.29 105.19 101.66 1pt7 n GLY 193 Ca -0.17 -1.90 -0.05 0.00 0.00 0.00 0.00 46.02 43.91 1pt7 n GLY 193 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1pt7 s GLN 194 N -5.09 1.56 -0.20 1.61 -2.07 -1.19 -4.89 119.66 109.39 1pt7 s GLN 194 Ca 0.62 -0.95 -0.10 0.00 -1.82 0.00 0.00 55.36 53.11 1pt7 s GLN 194 Cb -0.03 0.48 -0.05 0.00 -1.09 0.00 0.00 33.01 32.32 1pt7 s GLN 194 CO 0.42 -0.72 0.13 0.50 -1.32 0.00 0.00 175.29 174.29 1pt7 s ARG 195 N -2.81 4.15 -0.20 9.60 3.52 -1.26 -1.07 118.95 130.89 1pt7 s ARG 195 Ca 0.16 -0.24 -0.00 0.00 -0.13 0.00 0.00 55.73 55.51 1pt7 s ARG 195 Cb -0.03 -3.41 0.01 0.00 -1.56 0.00 0.00 34.95 29.96 1pt7 s ARG 195 CO 0.06 0.27 -0.14 0.08 -0.81 0.00 0.00 175.30 174.75 1pt7 s VAL 196 N 0.44 2.48 0.08 7.11 1.01 0.16 -4.95 120.40 126.72 1pt7 s VAL 196 Ca 0.07 -0.84 0.08 0.00 0.00 0.00 0.00 61.98 61.29 1pt7 s VAL 196 Cb -0.11 -2.10 -0.04 0.00 0.00 0.00 0.00 36.38 34.13 1pt7 s VAL 196 CO -0.01 0.47 -0.18 0.42 0.00 0.00 0.00 175.10 175.80 1pt7 s THR 197 N 1.34 2.80 -0.05 3.92 -4.23 -1.26 -1.15 115.64 117.00 1pt7 s THR 197 Ca 0.05 -1.34 -0.02 0.00 -1.18 0.00 0.00 61.69 59.20 1pt7 s THR 197 Cb -0.14 -2.23 0.04 0.00 1.34 0.00 0.00 72.50 71.51 1pt7 s THR 197 CO -0.10 0.23 0.11 -0.32 -0.54 0.00 0.00 174.62 174.01 1pt7 s MET 198 N -1.76 0.04 0.12 3.99 1.75 -0.54 -4.96 119.30 117.94 1pt7 s MET 198 Ca 0.16 0.35 0.03 0.00 -1.25 0.00 0.00 55.69 54.98 1pt7 s MET 198 Cb -0.11 -0.23 -0.04 0.00 2.84 0.00 0.00 34.83 37.30 1pt7 s MET 198 CO 0.07 -0.19 0.17 -1.54 -0.65 0.00 0.00 175.02 172.88 1pt7 s SER 199 N 1.34 5.88 0.12 1.11 1.04 -1.26 -1.74 113.70 120.20 1pt7 s SER 199 Ca -0.07 0.05 -0.11 0.00 0.48 0.00 0.00 55.95 56.30 1pt7 s SER 199 Cb -0.12 -1.67 -0.09 0.00 0.10 0.00 0.00 66.02 64.24 1pt7 s SER 199 CO -0.05 0.11 1.39 0.24 0.98 0.00 0.00 173.24 175.91 1pt7 h MET 200 N 2.69 0.87 -0.87 4.02 2.86 -1.03 -2.06 114.93 121.41 1pt7 h MET 200 Ca -0.47 -0.57 0.04 0.00 -2.06 0.00 0.00 59.70 56.64 1pt7 h MET 200 Cb 1.18 0.08 -0.05 0.00 0.06 0.00 0.00 31.60 32.86 1pt7 h MET 200 CO 0.68 1.20 0.56 0.37 1.06 0.00 0.00 176.91 180.77 1pt7 h GLN 201 N 0.65 1.03 0.00 1.72 4.15 -1.61 -2.11 115.11 118.95 1pt7 h GLN 201 Ca 0.00 -0.06 -0.07 0.00 0.77 0.00 0.00 58.65 59.29 1pt7 h GLN 201 Cb 1.19 -0.23 -0.01 0.00 0.21 0.00 0.00 27.48 28.64 1pt7 h GLN 201 CO 0.13 0.68 -0.33 -0.44 -1.93 0.00 0.00 178.83 176.94 1pt7 h ASP 202 N 1.06 0.00 -0.22 -0.69 3.32 -1.79 -1.98 116.42 116.12 1pt7 h ASP 202 Ca 0.36 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 57.26 1pt7 h ASP 202 Cb 0.06 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.61 1pt7 h ASP 202 CO -0.13 0.33 -0.45 0.00 -1.72 0.00 0.00 179.24 177.27 1pt7 h ALA 203 N 1.67 0.35 -0.27 3.45 0.00 -0.77 0.07 119.26 123.77 1pt7 h ALA 203 Ca -0.00 -0.47 -0.02 0.00 0.00 0.00 0.00 54.91 54.41 1pt7 h ALA 203 Cb 0.91 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 1pt7 h ALA 203 CO 0.04 0.49 0.08 0.28 0.00 0.00 0.00 179.25 180.15 1pt7 h VAL 204 N 0.41 1.20 -0.31 0.00 2.07 -1.28 -2.96 116.25 115.38 1pt7 h VAL 204 Ca 0.01 -0.63 0.02 0.00 0.82 0.00 0.00 66.70 66.92 1pt7 h VAL 204 Cb 1.05 1.11 -0.02 0.00 -1.52 0.00 0.00 31.29 31.90 1pt7 h VAL 204 CO 0.10 0.21 0.17 0.25 0.02 0.00 0.00 177.57 178.31 1pt7 h LEU 205 N 0.27 0.26 -0.76 2.57 5.85 -1.21 -2.00 115.31 120.28 1pt7 h LEU 205 Ca 0.09 0.01 0.12 0.00 0.84 0.00 0.00 57.88 58.93 1pt7 h LEU 205 Cb 0.24 -0.04 -0.08 0.00 0.37 0.00 0.00 40.66 41.14 1pt7 h LEU 205 CO -0.00 0.19 0.37 -1.13 -0.34 0.00 0.00 178.44 177.52 1pt7 h ASN 206 N 0.34 0.44 0.91 1.25 -1.24 -0.89 0.62 115.58 117.01 1pt7 h ASN 206 Ca 0.13 0.08 0.00 0.00 0.71 0.00 0.00 56.30 57.22 1pt7 h ASN 206 Cb 0.03 0.01 0.00 0.00 0.73 0.00 0.00 38.32 39.09 1pt7 h ASN 206 CO -0.08 0.22 0.00 -0.07 -1.29 0.00 0.00 177.43 176.21 1pt7 h LEU 207 N 0.58 0.00 -3.43 0.34 3.38 -1.24 -2.86 115.31 112.09 1pt7 h LEU 207 Ca 0.40 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.37 1pt7 h LEU 207 Cb 0.50 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.25 1pt7 h LEU 207 CO -0.32 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.21 1pt7 h ARG 209 N 3.95 0.17 0.00 0.00 2.43 -1.17 -0.74 114.38 119.01 1pt7 h ARG 209 Ca 0.00 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.14 1pt7 h ARG 209 Cb 1.80 -0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 31.31 1pt7 h ARG 209 CO 0.40 0.11 -0.08 -0.39 -1.51 0.00 0.00 179.97 178.50 1pt7 h VAL 210 N 0.17 0.25 0.00 0.20 -1.51 -1.87 -1.02 116.25 112.47 1pt7 h VAL 210 Ca 0.44 -0.63 -0.10 0.00 -1.23 0.00 0.00 66.70 65.18 1pt7 h VAL 210 Cb 0.80 1.50 -0.01 0.00 -2.13 0.00 0.00 31.29 31.45 1pt7 h VAL 210 CO -0.62 0.08 -0.47 0.11 -1.23 0.00 0.00 177.57 175.44 1pt7 h LYS 211 N 0.00 0.00 -0.01 5.19 1.79 -1.49 -1.90 116.57 120.14 1pt7 h LYS 211 Ca -0.00 0.00 -0.12 0.00 -2.18 0.00 0.00 60.65 58.35 1pt7 h LYS 211 Cb 0.50 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.13 1pt7 h LYS 211 CO 0.01 0.47 -0.58 1.25 -1.08 0.00 0.00 179.45 179.53 1pt7 h LEU 212 N 0.00 0.04 -0.42 2.94 5.85 -1.04 -1.04 115.31 121.64 1pt7 h LEU 212 Ca -0.00 -0.02 0.06 0.00 0.84 0.00 0.00 57.88 58.75 1pt7 h LEU 212 Cb 0.96 -0.01 -0.05 0.00 0.37 0.00 0.00 40.66 41.93 1pt7 h LEU 212 CO 0.06 0.61 0.14 -0.09 -0.34 0.00 0.00 178.44 178.81 1pt7 h ARG 213 N 0.02 0.28 -0.15 1.25 2.43 -1.17 -2.73 114.38 114.32 1pt7 h ARG 213 Ca -0.01 -0.02 -0.12 0.00 -0.81 0.00 0.00 59.98 59.03 1pt7 h ARG 213 Cb 1.03 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.50 1pt7 h ARG 213 CO 0.08 0.19 -0.43 -0.44 -1.51 0.00 0.00 179.97 177.85 1pt7 h ASP 214 N 0.29 0.37 -0.53 -3.80 3.32 -1.14 -1.70 116.42 113.22 1pt7 h ASP 214 Ca 0.20 -0.16 -0.03 0.00 0.02 0.00 0.00 57.03 57.06 1pt7 h ASP 214 Cb 0.20 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.62 1pt7 h ASP 214 CO -0.22 0.76 0.23 -0.61 -1.72 0.00 0.00 179.24 177.68 1pt7 h GLN 215 N 0.28 0.79 -0.56 3.56 5.75 -1.09 -0.51 115.11 123.34 1pt7 h GLN 215 Ca 0.02 -0.14 -0.11 0.00 -0.15 0.00 0.00 58.65 58.28 1pt7 h GLN 215 Cb 0.88 -0.13 -0.02 0.00 1.07 0.00 0.00 27.48 29.28 1pt7 h GLN 215 CO 0.07 0.68 -0.08 1.96 -2.65 0.00 0.00 178.83 178.82 1pt7 h GLN 216 N 0.72 1.05 -0.49 1.69 4.20 -1.17 -0.17 115.11 120.94 1pt7 h GLN 216 Ca 0.18 -0.37 0.04 0.00 0.06 0.00 0.00 58.65 58.56 1pt7 h GLN 216 Cb 0.18 -0.07 -0.04 0.00 0.30 0.00 0.00 27.48 27.84 1pt7 h GLN 216 CO -0.02 1.07 0.25 0.00 -0.67 0.00 0.00 178.83 179.46 1pt7 h ARG 217 N 0.93 0.47 -0.57 1.46 3.08 -1.15 -1.80 114.38 116.80 1pt7 h ARG 217 Ca 0.15 -0.03 -0.03 0.00 0.07 0.00 0.00 59.98 60.14 1pt7 h ARG 217 Cb 0.65 -0.11 -0.03 0.00 0.08 0.00 0.00 29.97 30.56 1pt7 h ARG 217 CO 0.04 0.31 0.23 1.25 -1.07 0.00 0.00 179.97 180.74 1pt7 h LEU 218 N 0.49 0.79 -1.15 3.04 5.85 -0.71 0.37 115.31 123.98 1pt7 h LEU 218 Ca 0.21 -0.17 0.02 0.00 0.84 0.00 0.00 57.88 58.78 1pt7 h LEU 218 Cb 0.11 -0.20 -0.05 0.00 0.37 0.00 0.00 40.66 40.89 1pt7 h LEU 218 CO -0.14 0.74 0.58 0.44 -0.34 0.00 0.00 178.44 179.71 1pt7 h ASP 219 N 0.78 0.98 0.31 1.25 3.32 -0.60 0.16 116.42 122.62 1pt7 h ASP 219 Ca 0.19 -0.02 -0.33 0.00 0.02 0.00 0.00 57.03 56.89 1pt7 h ASP 219 Cb 0.19 -0.24 0.02 0.00 0.22 0.00 0.00 39.33 39.53 1pt7 h ASP 219 CO -0.02 0.69 -1.54 0.50 -1.72 0.00 0.00 179.24 177.16 1pt7 h LYS 220 N 1.15 0.44 0.00 3.56 1.63 -0.79 -3.40 116.57 119.15 1pt7 h LYS 220 Ca 0.33 -0.75 -0.22 0.00 -0.85 0.00 0.00 60.65 59.16 1pt7 h LYS 220 Cb -0.08 0.28 -0.04 0.00 -0.60 0.00 0.00 32.23 31.79 1pt7 h LYS 220 CO -0.08 1.35 -1.82 1.28 -3.45 0.00 0.00 179.45 176.72 1pt7 n LEU 221 N -3.63 0.09 0.00 5.20 4.77 0.07 -5.02 117.00 118.48 1pt7 n LEU 221 Ca -0.18 -0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.80 1pt7 n LEU 221 Cb 1.08 0.27 0.00 0.00 -2.33 0.00 0.00 43.42 42.44 1pt7 n LEU 221 CO 0.56 0.31 0.00 0.61 -1.33 0.00 0.00 177.39 177.54 1pt7 n GLY 222 N 2.28 0.92 3.37 -0.72 0.00 0.54 -5.02 105.19 106.56 1pt7 n GLY 222 Ca -0.20 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.73 1pt7 n GLY 222 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1pt7 s TYR 223 N -3.67 0.15 -0.28 1.61 -0.85 -1.26 -4.75 117.35 108.30 1pt7 s TYR 223 Ca 0.00 -0.51 0.01 0.00 -0.52 0.00 0.00 57.07 56.05 1pt7 s TYR 223 Cb 0.00 0.10 0.08 0.00 0.38 0.00 0.00 41.96 42.52 1pt7 s TYR 223 CO 0.00 -0.75 -0.00 -0.51 -1.52 0.00 0.00 175.55 172.77 1pt7 s LEU 224 N -2.91 3.09 0.59 -3.49 1.43 -1.26 -4.51 118.68 111.62 1pt7 s LEU 224 Ca 0.12 -1.51 0.30 0.00 -1.03 0.00 0.00 54.13 52.00 1pt7 s LEU 224 Cb 0.02 -1.25 1.77 0.00 0.03 0.00 0.00 46.19 46.76 1pt7 s LEU 224 CO -0.04 -0.30 2.19 1.05 0.23 0.00 0.00 176.35 179.48 1pt7 h GLU 225 N 7.89 0.00 -0.01 1.70 4.11 -2.00 -1.09 114.58 125.17 1pt7 h GLU 225 Ca -0.14 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.29 1pt7 h GLU 225 Cb 1.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.30 1pt7 h GLU 225 CO 0.45 0.00 -0.40 -0.85 0.07 0.00 0.00 179.01 178.28 1pt7 n GLU 226 N -3.80 1.46 -2.69 1.06 0.00 -1.26 -4.79 120.64 110.63 1pt7 n GLU 226 Ca -0.01 -0.93 -0.33 0.00 0.00 0.00 0.00 57.16 55.90 1pt7 n GLU 226 Cb 0.19 -1.38 -0.05 0.00 0.00 0.00 0.00 31.44 30.20 1pt7 n GLU 226 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.13 177.84 1pt7 s TYR 227 N -2.18 3.37 0.53 -1.84 1.51 -0.41 -4.94 117.35 113.40 1pt7 s TYR 227 Ca 0.16 1.51 0.26 0.00 -1.01 0.00 0.00 57.07 58.00 1pt7 s TYR 227 Cb 0.16 -2.79 1.41 0.00 -0.11 0.00 0.00 41.96 40.63 1pt7 s TYR 227 CO 0.48 -0.19 1.98 -1.35 -1.11 0.00 0.00 175.55 175.36 1pt7 h PRO 228 N 1.54 0.00 0.00 -1.71 0.11 -1.87 -0.21 132.00 129.87 1pt7 h PRO 228 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1pt7 h PRO 228 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1pt7 h PRO 228 CO 0.62 0.00 0.00 1.04 -0.21 0.00 0.00 178.00 179.45 1pt7 n GLN 229 N -4.35 0.20 -4.11 1.05 3.00 -1.26 -4.72 117.38 107.19 1pt7 n GLN 229 Ca 0.11 0.14 -0.34 0.00 -0.01 0.00 0.00 57.00 56.90 1pt7 n GLN 229 Cb 0.67 -1.50 -0.10 0.00 0.00 0.00 0.00 30.24 29.30 1pt7 n GLN 229 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.06 176.59 1pt7 s TYR 230 N -2.64 3.19 -1.80 1.08 5.04 -0.09 -0.48 117.35 121.64 1pt7 s TYR 230 Ca 0.15 -0.02 0.16 0.00 -2.44 0.00 0.00 57.07 54.92 1pt7 s TYR 230 Cb 0.11 -2.05 0.26 0.00 0.35 0.00 0.00 41.96 40.64 1pt7 s TYR 230 CO 0.26 0.11 1.17 -0.35 -1.34 0.00 0.00 175.55 175.40 1pt7 n PRO 231 N 3.53 1.91 0.00 4.97 -0.04 -1.26 -4.55 135.00 139.55 1pt7 n PRO 231 Ca -0.17 -1.82 0.11 0.00 -0.04 0.00 0.00 63.50 61.58 1pt7 n PRO 231 Cb 0.52 -1.35 0.04 0.00 -0.04 0.00 0.00 33.50 32.67 1pt7 n PRO 231 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1pt7 n ASN 232 N 0.97 1.12 0.00 3.54 3.02 -1.22 -4.94 115.26 117.75 1pt7 n ASN 232 Ca 0.13 -0.93 0.00 0.00 -0.03 0.00 0.00 54.58 53.74 1pt7 n ASN 232 Cb 0.45 0.62 0.00 0.00 -0.61 0.00 0.00 39.78 40.25 1pt7 n ASN 232 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1pt7 n GLY 233 N 1.46 2.84 3.18 7.41 0.00 0.36 -5.11 105.19 115.34 1pt7 n GLY 233 Ca 0.06 -2.00 -0.25 0.00 0.00 0.00 0.00 46.02 43.83 1pt7 n GLY 233 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1pt7 s THR 234 N 2.05 1.45 -0.15 2.61 2.01 -1.25 -4.84 115.64 117.51 1pt7 s THR 234 Ca 0.00 -0.79 -0.04 0.00 0.31 0.00 0.00 61.69 61.17 1pt7 s THR 234 Cb 0.00 -1.21 -0.03 0.00 0.01 0.00 0.00 72.50 71.27 1pt7 s THR 234 CO 0.00 0.41 -0.01 -0.36 -0.69 0.00 0.00 174.62 173.97 1pt7 s PHE 235 N -0.43 3.09 0.00 4.92 0.40 -1.26 -4.92 117.98 119.77 1pt7 s PHE 235 Ca 0.07 -0.15 0.00 0.00 -0.60 0.00 0.00 56.93 56.25 1pt7 s PHE 235 Cb -0.07 -1.97 0.00 0.00 0.51 0.00 0.00 43.02 41.49 1pt7 s PHE 235 CO -0.01 0.07 0.00 0.41 0.70 0.00 0.00 175.22 176.39 1pt7 n GLY 236 N 3.37 1.08 0.05 4.36 0.00 -1.26 -5.03 105.19 107.76 1pt7 n GLY 236 Ca -0.17 -1.89 0.12 0.00 0.00 0.00 0.00 46.02 44.08 1pt7 n GLY 236 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1pt7 n ASP 237 N 0.00 0.60 -4.55 1.61 5.68 -1.26 -4.84 116.55 113.79 1pt7 n ASP 237 Ca 0.00 0.10 -0.30 0.00 -0.50 0.00 0.00 54.79 54.09 1pt7 n ASP 237 Cb 0.00 0.04 -0.10 0.00 -1.14 0.00 0.00 41.12 39.92 1pt7 n ASP 237 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1pt7 s ALA 238 N -3.11 2.89 -0.02 2.12 0.00 -1.26 -4.86 121.76 117.52 1pt7 s ALA 238 Ca 0.08 -1.24 -0.37 0.00 0.00 0.00 0.00 51.96 50.44 1pt7 s ALA 238 Cb 0.15 -0.86 -0.15 0.00 0.00 0.00 0.00 23.12 22.25 1pt7 s ALA 238 CO 0.69 0.63 1.57 0.28 0.00 0.00 0.00 175.76 178.92 1pt7 n VAL 239 N 0.87 0.16 -2.84 0.00 0.31 -1.26 -4.93 118.33 110.64 1pt7 n VAL 239 Ca -0.14 -0.03 -0.22 0.00 -0.01 0.00 0.00 64.34 63.94 1pt7 n VAL 239 Cb 0.52 -1.20 0.02 0.00 -0.91 0.00 0.00 33.84 32.27 1pt7 n VAL 239 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1pt7 s PRO 240 N 1.87 2.85 0.46 5.55 0.04 -1.26 -4.80 135.00 139.70 1pt7 s PRO 240 Ca 0.88 -0.61 -0.23 0.00 0.04 0.00 0.00 61.00 61.08 1pt7 s PRO 240 Cb -0.90 -2.53 -0.07 0.00 0.04 0.00 0.00 34.50 31.04 1pt7 s PRO 240 CO 0.51 -0.45 1.19 1.03 0.04 0.00 0.00 177.00 179.32 1pt7 s ARG 241 N -4.64 3.75 -0.01 4.56 0.52 -1.26 -4.88 118.95 116.99 1pt7 s ARG 241 Ca 0.52 1.85 0.02 0.00 -0.52 0.00 0.00 55.73 57.59 1pt7 s ARG 241 Cb -0.10 -2.45 0.02 0.00 0.52 0.00 0.00 34.95 32.94 1pt7 s ARG 241 CO 0.38 -0.58 0.85 0.41 0.02 0.00 0.00 175.30 176.38 1pt7 n GLY 242 N 0.51 1.10 7.00 -3.53 0.00 -1.22 -3.81 105.19 105.23 1pt7 n GLY 242 Ca 0.07 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1pt7 n GLY 242 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pt7 n GLY 243 N -0.39 3.20 2.02 -0.02 0.00 0.73 -2.02 105.19 108.72 1pt7 n GLY 243 Ca 0.01 -0.16 -0.05 0.00 0.00 0.00 0.00 46.02 45.83 1pt7 n GLY 243 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1pt7 n ASN 244 N 6.54 4.99 -4.71 1.61 3.02 -1.26 -4.63 115.26 120.82 1pt7 n ASN 244 Ca 0.00 -3.19 -0.33 0.00 -0.03 0.00 0.00 54.58 51.04 1pt7 n ASN 244 Cb 0.00 -0.75 0.12 0.00 -0.61 0.00 0.00 39.78 38.54 1pt7 n ASN 244 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1pt7 s ALA 245 N -2.96 1.91 0.26 5.41 0.00 -0.85 -3.85 121.76 121.67 1pt7 s ALA 245 Ca 0.55 0.70 -0.03 0.00 0.00 0.00 0.00 51.96 53.18 1pt7 s ALA 245 Cb 0.44 -3.44 0.40 0.00 0.00 0.00 0.00 23.12 20.52 1pt7 s ALA 245 CO 0.14 -2.17 1.87 0.78 0.00 0.00 0.00 175.76 176.38 1pt7 h GLY 246 N -0.95 1.46 0.00 0.00 0.00 -1.77 -3.46 103.07 98.35 1pt7 h GLY 246 Ca -0.45 -0.44 0.00 0.00 0.00 0.00 0.00 47.33 46.43 1pt7 h GLY 246 CO 0.47 0.30 0.00 0.61 0.00 0.00 0.00 176.54 177.92 1pt7 n GLY 247 N -1.35 1.54 0.00 4.60 0.00 -1.26 -4.93 105.19 103.79 1pt7 n GLY 247 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1pt7 n GLY 247 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pt7 n GLY 248 N -2.00 5.60 0.24 -0.02 0.00 -1.26 -4.98 105.19 102.76 1pt7 n GLY 248 Ca 0.00 -1.02 0.14 0.00 0.00 0.00 0.00 46.02 45.14 1pt7 n GLY 248 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pt7 n GLY 249 N 0.53 -0.61 2.97 -0.02 0.00 -1.26 -4.77 105.19 102.03 1pt7 n GLY 249 Ca 0.00 -0.35 -0.30 0.00 0.00 0.00 0.00 46.02 45.37 1pt7 n GLY 249 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1pt7 s GLN 250 N -2.34 1.88 0.57 1.61 -1.52 -1.26 -4.88 119.66 113.72 1pt7 s GLN 250 Ca 0.31 -0.75 -0.17 0.00 -1.95 0.00 0.00 55.36 52.80 1pt7 s GLN 250 Cb 0.20 -2.31 -0.05 0.00 -0.22 0.00 0.00 33.01 30.64 1pt7 s GLN 250 CO 0.45 -0.43 1.06 -1.25 -0.25 0.00 0.00 175.29 174.87 1pt7 s PRO 251 N 1.46 3.39 0.37 2.91 0.04 -1.25 -4.40 135.00 137.52 1pt7 s PRO 251 Ca -0.01 1.28 -0.13 0.00 0.04 0.00 0.00 61.00 62.18 1pt7 s PRO 251 Cb -0.16 -2.04 0.05 0.00 0.04 0.00 0.00 34.50 32.40 1pt7 s PRO 251 CO -0.08 -0.76 0.73 0.41 0.04 0.00 0.00 177.00 177.34 1pt7 n GLY 252 N -0.72 1.10 3.58 0.56 0.00 -1.26 -0.78 105.19 107.67 1pt7 n GLY 252 Ca 0.09 -1.26 -0.10 0.00 0.00 0.00 0.00 46.02 44.75 1pt7 n GLY 252 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1pt7 s TRP 253 N -2.58 -0.36 -0.31 1.61 -0.11 -0.48 -3.85 118.94 112.87 1pt7 s TRP 253 Ca 0.16 0.04 -0.20 0.00 1.22 0.00 0.00 56.10 57.32 1pt7 s TRP 253 Cb -0.04 0.58 -0.01 0.00 -1.50 0.00 0.00 33.47 32.49 1pt7 s TRP 253 CO 0.12 -0.99 0.60 0.42 -4.62 0.00 0.00 176.95 172.48 1pt7 s ILE 254 N -3.83 4.97 -0.07 5.86 -1.09 -1.26 -1.24 121.20 124.54 1pt7 s ILE 254 Ca 0.06 0.78 0.01 0.00 -2.23 0.00 0.00 60.65 59.27 1pt7 s ILE 254 Cb -0.03 -3.97 -0.03 0.00 -1.58 0.00 0.00 42.46 36.86 1pt7 s ILE 254 CO -0.05 -0.12 -0.10 -0.76 -1.23 0.00 0.00 174.94 172.68 1pt7 s LEU 255 N 2.54 3.00 0.29 2.97 1.43 0.47 -4.96 118.68 124.42 1pt7 s LEU 255 Ca 0.24 -0.11 -0.29 0.00 -1.03 0.00 0.00 54.13 52.93 1pt7 s LEU 255 Cb -0.15 -1.65 -0.10 0.00 0.03 0.00 0.00 46.19 44.32 1pt7 s LEU 255 CO 0.12 0.33 1.44 -0.54 0.23 0.00 0.00 176.35 177.92 1pt7 s LYS 256 N -0.60 4.25 0.47 1.70 1.02 -1.26 -1.23 119.74 124.09 1pt7 s LYS 256 Ca 0.09 2.36 0.04 0.00 0.02 0.00 0.00 55.97 58.48 1pt7 s LYS 256 Cb -0.12 -3.07 -0.03 0.00 -0.52 0.00 0.00 37.83 34.10 1pt7 s LYS 256 CO 0.02 -0.41 0.10 0.00 -0.92 0.00 0.00 175.35 174.14 1pt7 n LYS 258 N -1.27 2.68 0.00 0.00 4.81 -0.20 -2.31 118.16 121.86 1pt7 n LYS 258 Ca -0.09 0.97 0.00 0.00 -0.87 0.00 0.00 58.31 58.31 1pt7 n LYS 258 Cb 0.66 -2.80 0.00 0.00 0.02 0.00 0.00 35.03 32.91 1pt7 n LYS 258 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1pt7 n GLY 259 N 3.89 0.50 0.30 3.14 0.00 -1.26 -4.66 105.19 107.10 1pt7 n GLY 259 Ca 0.16 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.34 1pt7 n GLY 259 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 173.32 173.43 1pt7 h TRP 260 N 0.00 0.00 -0.32 1.61 5.08 -1.64 0.13 115.95 120.81 1pt7 h TRP 260 Ca 0.00 0.00 -0.08 0.00 1.08 0.00 0.00 58.89 59.89 1pt7 h TRP 260 Cb 0.00 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 26.14 1pt7 h TRP 260 CO 0.00 0.00 -0.13 0.93 -1.28 0.00 0.00 178.44 177.97 1pt7 h GLU 261 N 0.00 0.55 0.00 0.12 3.07 -1.94 -3.26 114.58 113.12 1pt7 h GLU 261 Ca -0.00 -0.17 0.00 0.00 -0.50 0.00 0.00 59.36 58.69 1pt7 h GLU 261 Cb 0.01 -0.06 0.00 0.00 -0.84 0.00 0.00 28.75 27.86 1pt7 h GLU 261 CO 0.00 0.67 -0.65 0.25 -1.40 0.00 0.00 179.01 177.87 1pt7 n THR 262 N -4.19 0.00 -4.05 1.13 -2.24 -0.80 -4.93 114.28 99.20 1pt7 n THR 262 Ca 0.01 -0.27 -0.32 0.00 -2.27 0.00 0.00 64.05 61.19 1pt7 n THR 262 Cb 0.33 0.84 -0.15 0.00 -2.10 0.00 0.00 70.33 69.26 1pt7 n THR 262 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1pt7 s ASP 263 N -2.13 4.50 0.00 3.42 -1.08 0.37 -4.99 116.67 116.76 1pt7 s ASP 263 Ca 0.02 -1.38 0.16 0.00 -0.52 0.00 0.00 52.55 50.83 1pt7 s ASP 263 Cb 0.07 -1.57 0.86 0.00 -1.46 0.00 0.00 42.92 40.82 1pt7 s ASP 263 CO 0.38 -0.20 1.46 -0.81 0.52 0.00 0.00 175.17 176.52 1pt7 n PRO 264 N 4.46 0.29 -0.14 4.34 -0.04 -1.26 -2.13 135.00 140.51 1pt7 n PRO 264 Ca -0.14 0.11 0.06 0.00 -0.04 0.00 0.00 63.50 63.49 1pt7 n PRO 264 Cb 0.42 -1.50 0.13 0.00 -0.04 0.00 0.00 33.50 32.51 1pt7 n PRO 264 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1pt7 n ASN 265 N -1.23 2.65 -3.88 3.54 3.02 -1.26 -4.86 115.26 113.25 1pt7 n ASN 265 Ca 0.09 -2.57 -0.42 0.00 -0.03 0.00 0.00 54.58 51.64 1pt7 n ASN 265 Cb 0.12 -0.29 0.00 0.00 -0.61 0.00 0.00 39.78 38.99 1pt7 n ASN 265 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1pt7 n ALA 266 N -0.65 5.22 -2.68 5.41 0.00 -0.90 -4.55 120.51 122.36 1pt7 n ALA 266 Ca 0.12 -3.95 -0.09 0.00 0.00 0.00 0.00 53.44 49.52 1pt7 n ALA 266 Cb 0.54 -3.46 -0.07 0.00 0.00 0.00 0.00 19.45 16.47 1pt7 n ALA 266 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1pt7 s TYR 267 N 2.89 0.10 0.18 0.00 1.51 -1.26 -0.84 117.35 119.92 1pt7 s TYR 267 Ca 0.47 -0.50 0.07 0.00 -1.01 0.00 0.00 57.07 56.11 1pt7 s TYR 267 Cb 0.12 0.02 -0.04 0.00 -0.11 0.00 0.00 41.96 41.94 1pt7 s TYR 267 CO -0.05 -0.60 -0.15 0.96 -1.11 0.00 0.00 175.55 174.59 1pt7 s ILE 268 N -3.86 1.67 -0.03 2.71 -4.36 -0.37 -1.44 121.20 115.52 1pt7 s ILE 268 Ca 0.06 -2.07 -0.17 0.00 -0.26 0.00 0.00 60.65 58.21 1pt7 s ILE 268 Cb 0.04 -1.91 -0.05 0.00 1.25 0.00 0.00 42.46 41.78 1pt7 s ILE 268 CO -0.10 -0.51 0.47 -0.47 0.24 0.00 0.00 174.94 174.57 1pt7 s TYR 269 N -2.65 3.66 -0.07 1.37 5.04 -0.53 -0.39 117.35 123.78 1pt7 s TYR 269 Ca 0.19 1.01 0.01 0.00 -2.44 0.00 0.00 57.07 55.84 1pt7 s TYR 269 Cb -0.02 -2.43 0.02 0.00 0.35 0.00 0.00 41.96 39.87 1pt7 s TYR 269 CO 0.06 0.45 -0.07 0.12 -1.34 0.00 0.00 175.55 174.77 1pt7 s PHE 270 N -0.43 1.14 -0.19 4.97 5.36 -0.37 -2.55 117.98 125.91 1pt7 s PHE 270 Ca 0.26 -0.44 -0.08 0.00 -0.96 0.00 0.00 56.93 55.71 1pt7 s PHE 270 Cb -0.17 -0.95 -0.04 0.00 -0.34 0.00 0.00 43.02 41.52 1pt7 s PHE 270 CO 0.13 -0.32 0.07 0.99 -1.46 0.00 0.00 175.22 174.64 1pt7 s THR 271 N 1.16 4.77 -0.76 0.12 2.01 -0.69 -1.38 115.64 120.86 1pt7 s THR 271 Ca -0.06 -0.04 -0.20 0.00 0.31 0.00 0.00 61.69 61.70 1pt7 s THR 271 Cb -0.14 -3.16 0.10 0.00 0.01 0.00 0.00 72.50 69.31 1pt7 s THR 271 CO -0.01 0.44 0.99 -0.63 -0.69 0.00 0.00 174.62 174.72 1pt7 s ILE 272 N 0.55 4.57 0.08 1.82 1.01 0.04 -4.20 121.20 125.06 1pt7 s ILE 272 Ca 0.03 -0.98 -0.28 0.00 0.00 0.00 0.00 60.65 59.42 1pt7 s ILE 272 Cb -0.13 -4.70 -0.05 0.00 0.01 0.00 0.00 42.46 37.59 1pt7 s ILE 272 CO 0.01 -1.43 0.90 -1.58 0.00 0.00 0.00 174.94 172.84 1pt7 s GLN 273 N 3.26 4.62 0.24 2.79 -0.44 -1.26 -3.94 119.66 124.93 1pt7 s GLN 273 Ca 0.25 1.33 -0.04 0.00 -2.50 0.00 0.00 55.36 54.39 1pt7 s GLN 273 Cb -0.13 -3.38 0.40 0.00 -1.64 0.00 0.00 33.01 28.26 1pt7 s GLN 273 CO 0.01 0.20 1.80 1.49 0.50 0.00 0.00 175.29 179.29 1pt7 h GLU 274 N 5.77 0.72 -0.01 1.67 4.81 -1.96 0.82 114.58 126.39 1pt7 h GLU 274 Ca -0.43 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.76 1pt7 h GLU 274 Cb 1.21 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 30.43 1pt7 h GLU 274 CO 0.72 0.47 0.00 1.04 -0.73 0.00 0.00 179.01 180.51 1pt7 n GLN 275 N -4.78 1.22 -0.27 1.92 3.00 -1.26 -4.10 117.38 113.11 1pt7 n GLN 275 Ca 0.13 -0.32 0.08 0.00 -0.01 0.00 0.00 57.00 56.89 1pt7 n GLN 275 Cb 0.29 -1.47 0.17 0.00 0.00 0.00 0.00 30.24 29.23 1pt7 n GLN 275 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.06 175.35 1pt7 n ASN 276 N -0.59 2.18 -0.15 1.08 4.05 0.28 -4.79 115.26 117.31 1pt7 n ASN 276 Ca 0.21 -3.38 -0.11 0.00 0.45 0.00 0.00 54.58 51.76 1pt7 n ASN 276 Cb 0.18 -0.47 -0.01 0.00 1.23 0.00 0.00 39.78 40.71 1pt7 n ASN 276 CO 0.00 0.00 0.00 -0.25 -3.05 0.00 0.00 177.26 173.96 1pt7 h TRP 277 N 0.41 0.96 -0.05 1.20 2.91 -1.71 -0.99 115.95 118.68 1pt7 h TRP 277 Ca 0.00 -0.20 -0.00 0.00 1.13 0.00 0.00 58.89 59.82 1pt7 h TRP 277 Cb 1.03 -0.24 -0.00 0.00 -0.51 0.00 0.00 29.16 29.44 1pt7 h TRP 277 CO 0.29 0.95 0.03 1.49 -1.03 0.00 0.00 178.44 180.17 1pt7 h GLU 278 N 0.69 0.07 -0.78 2.65 4.81 -1.90 -0.52 114.58 119.60 1pt7 h GLU 278 Ca 0.12 -0.01 0.08 0.00 -0.13 0.00 0.00 59.36 59.42 1pt7 h GLU 278 Cb 0.63 -0.01 -0.07 0.00 0.63 0.00 0.00 28.75 29.93 1pt7 h GLU 278 CO 0.04 0.10 0.44 -0.91 -0.73 0.00 0.00 179.01 177.95 1pt7 h ASN 279 N 0.02 0.64 -0.76 1.04 2.35 -1.85 -1.21 115.58 115.82 1pt7 h ASN 279 Ca 0.02 0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.81 1pt7 h ASN 279 Cb 0.05 -0.08 -0.04 0.00 0.05 0.00 0.00 38.32 38.30 1pt7 h ASN 279 CO -0.00 0.38 0.49 0.74 -1.65 0.00 0.00 177.43 177.39 1pt7 h THR 280 N 0.77 1.20 -0.68 2.81 2.02 -0.45 -0.76 112.91 117.81 1pt7 h THR 280 Ca 0.37 -0.38 -0.06 0.00 0.77 0.00 0.00 66.41 67.11 1pt7 h THR 280 Cb 0.30 0.09 -0.03 0.00 -1.74 0.00 0.00 68.15 66.78 1pt7 h THR 280 CO -0.23 0.20 0.20 0.00 0.37 0.00 0.00 175.52 176.06 1pt7 h LYS 282 N 1.02 0.70 -0.85 0.00 1.79 -0.88 0.21 116.57 118.57 1pt7 h LYS 282 Ca 0.22 -0.28 0.11 0.00 -2.18 0.00 0.00 60.65 58.52 1pt7 h LYS 282 Cb 0.31 -0.03 -0.08 0.00 -1.58 0.00 0.00 32.23 30.85 1pt7 h LYS 282 CO -0.00 0.88 0.48 0.00 -1.08 0.00 0.00 179.45 179.73 1pt7 h ALA 283 N 0.80 1.24 -0.13 3.86 0.00 -0.91 -2.84 119.26 121.29 1pt7 h ALA 283 Ca 0.08 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1pt7 h ALA 283 Cb 0.64 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1pt7 h ALA 283 CO 0.04 0.07 0.00 0.44 0.00 0.00 0.00 179.25 179.81 1pt7 n ILE 284 N -4.75 0.14 -2.94 0.00 -5.35 -1.02 -4.97 119.36 100.45 1pt7 n ILE 284 Ca 0.15 -0.54 -0.11 0.00 -0.27 0.00 0.00 62.75 61.98 1pt7 n ILE 284 Cb 0.32 1.26 0.04 0.00 -1.74 0.00 0.00 39.64 39.52 1pt7 n ILE 284 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1pt7 n GLY 285 N 1.37 0.21 2.82 3.28 0.00 0.49 -4.99 105.19 108.38 1pt7 n GLY 285 Ca 0.16 -0.23 -0.27 0.00 0.00 0.00 0.00 46.02 45.68 1pt7 n GLY 285 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1pt7 n LYS 286 N -2.59 3.04 0.27 1.61 4.76 0.29 -4.92 118.16 120.62 1pt7 n LYS 286 Ca -0.02 -4.78 0.11 0.00 -2.87 0.00 0.00 58.31 50.74 1pt7 n LYS 286 Cb 0.54 -2.22 0.73 0.00 -1.84 0.00 0.00 35.03 32.24 1pt7 n LYS 286 CO 0.00 0.00 0.00 -1.00 -1.37 0.00 0.00 177.40 175.03 1pt7 h PRO 287 N 3.19 0.00 0.00 1.97 0.13 -1.94 -1.21 132.00 134.14 1pt7 h PRO 287 Ca 0.14 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.26 1pt7 h PRO 287 Cb 0.54 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.67 1pt7 h PRO 287 CO 0.81 0.05 -0.04 0.93 -0.23 0.00 0.00 178.00 179.52 1pt7 h GLU 288 N 0.00 0.00 0.00 0.86 3.07 -1.96 -2.40 114.58 114.15 1pt7 h GLU 288 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1pt7 h GLU 288 Cb 0.11 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.02 1pt7 h GLU 288 CO 0.01 0.04 -0.07 0.91 -1.40 0.00 0.00 179.01 178.50 1pt7 n TRP 289 N -4.09 0.14 -0.07 4.33 7.02 -0.46 -3.58 117.44 120.74 1pt7 n TRP 289 Ca -0.03 0.04 -0.10 0.00 -1.02 0.00 0.00 57.50 56.39 1pt7 n TRP 289 Cb 0.13 -0.54 -0.04 0.00 -2.42 0.00 0.00 31.31 28.44 1pt7 n TRP 289 CO 0.00 0.00 0.00 0.82 -2.02 0.00 0.00 177.69 176.49 1pt7 h ILE 290 N 0.00 1.18 -0.01 -0.99 2.04 -1.55 -3.32 117.51 114.86 1pt7 h ILE 290 Ca 0.00 -0.54 0.00 0.00 1.00 0.00 0.00 64.86 65.32 1pt7 h ILE 290 Cb 0.54 1.10 0.00 0.00 -0.74 0.00 0.00 36.82 37.72 1pt7 h ILE 290 CO 0.00 0.18 -0.11 0.35 0.00 0.00 0.00 178.15 178.57 1pt7 n THR 291 N -4.79 0.00 -1.67 -0.27 -2.24 -1.26 -4.52 114.28 99.52 1pt7 n THR 291 Ca -0.03 -0.45 -0.42 0.00 -2.27 0.00 0.00 64.05 60.88 1pt7 n THR 291 Cb 0.14 1.19 -0.03 0.00 -2.10 0.00 0.00 70.33 69.52 1pt7 n THR 291 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1pt7 n ASP 292 N 0.23 4.09 0.34 3.42 -0.08 -1.23 -4.82 116.55 118.50 1pt7 n ASP 292 Ca 0.06 0.94 0.22 0.00 -1.51 0.00 0.00 54.79 54.50 1pt7 n ASP 292 Cb 0.26 -1.53 1.17 0.00 2.34 0.00 0.00 41.12 43.37 1pt7 n ASP 292 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1pt7 h PRO 293 N 9.72 0.00 0.00 -0.67 0.13 -1.93 -0.58 132.00 138.67 1pt7 h PRO 293 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1pt7 h PRO 293 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 1pt7 h PRO 293 CO 0.94 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.71 1pt7 h ALA 294 N 1.92 1.00 0.00 -0.56 0.00 -1.91 -3.34 119.26 116.37 1pt7 h ALA 294 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1pt7 h ALA 294 Cb 0.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1pt7 h ALA 294 CO -0.00 0.00 -0.24 0.66 0.00 0.00 0.00 179.25 179.67 1pt7 n TYR 295 N -2.32 0.00 0.52 0.00 4.02 -0.43 -3.83 117.16 115.13 1pt7 n TYR 295 Ca 0.02 0.00 0.13 0.00 -0.01 0.00 0.00 57.90 58.03 1pt7 n TYR 295 Cb 0.21 0.00 0.37 0.00 -0.02 0.00 0.00 39.34 39.91 1pt7 n TYR 295 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 1pt7 h SER 296 N 0.00 0.00 -3.06 7.72 4.64 -1.29 -3.43 113.55 118.13 1pt7 h SER 296 Ca 0.00 0.00 -0.50 0.00 -0.47 0.00 0.00 61.79 60.82 1pt7 h SER 296 Cb 0.00 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 61.94 1pt7 h SER 296 CO 0.00 0.00 -0.75 0.42 -0.87 0.00 0.00 176.83 175.63 1pt7 s THR 297 N -3.15 1.92 0.28 2.95 -4.23 -1.26 -5.00 115.64 107.14 1pt7 s THR 297 Ca 0.09 -2.19 -0.03 0.00 -1.18 0.00 0.00 61.69 58.37 1pt7 s THR 297 Cb 0.11 -2.06 0.26 0.00 1.34 0.00 0.00 72.50 72.15 1pt7 s THR 297 CO 0.60 -0.49 1.95 0.00 -0.54 0.00 0.00 174.62 176.13 1pt7 h ALA 298 N 2.64 1.36 -0.39 3.99 0.00 -1.91 -0.23 119.26 124.73 1pt7 h ALA 298 Ca -0.39 -0.06 0.07 0.00 0.00 0.00 0.00 54.91 54.53 1pt7 h ALA 298 Cb 1.23 -0.36 -0.06 0.00 0.00 0.00 0.00 17.79 18.59 1pt7 h ALA 298 CO 0.59 0.58 -0.00 1.25 0.00 0.00 0.00 179.25 181.67 1pt7 h HIS 299 N 1.22 -0.03 -0.01 0.00 -0.00 -1.97 -1.06 115.15 113.30 1pt7 h HIS 299 Ca 0.34 0.03 -0.16 0.00 -0.00 0.00 0.00 60.37 60.58 1pt7 h HIS 299 Cb -0.10 0.07 -0.02 0.00 -0.00 0.00 0.00 27.41 27.36 1pt7 h HIS 299 CO -0.00 -0.08 -0.74 0.00 -0.00 0.00 0.00 177.93 177.11 1pt7 h ALA 300 N 1.34 0.75 -0.13 5.26 0.00 -1.65 -3.16 119.26 121.67 1pt7 h ALA 300 Ca 0.19 -0.66 -0.14 0.00 0.00 0.00 0.00 54.91 54.31 1pt7 h ALA 300 Cb 0.27 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1pt7 h ALA 300 CO -0.32 0.88 -0.50 0.00 0.00 0.00 0.00 179.25 179.31 1pt7 h ARG 301 N 0.05 0.36 -0.41 0.00 3.08 -0.50 -3.37 114.38 113.59 1pt7 h ARG 301 Ca -0.01 -0.21 0.07 0.00 0.07 0.00 0.00 59.98 59.90 1pt7 h ARG 301 Cb 1.30 0.02 -0.06 0.00 0.08 0.00 0.00 29.97 31.31 1pt7 h ARG 301 CO 0.10 0.78 0.06 0.37 -1.07 0.00 0.00 179.97 180.21 1pt7 h GLN 302 N 0.28 0.17 0.00 0.04 5.75 -1.17 -1.28 115.11 118.90 1pt7 h GLN 302 Ca 0.01 -0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 1pt7 h GLN 302 Cb 0.98 -0.04 0.00 0.00 1.07 0.00 0.00 27.48 29.50 1pt7 h GLN 302 CO 0.08 0.11 0.00 -1.35 -2.65 0.00 0.00 178.83 175.03 1pt7 h PRO 303 N 0.18 0.00 -0.32 -2.39 0.11 -1.77 -2.79 132.00 125.02 1pt7 h PRO 303 Ca 0.20 0.00 -0.25 0.00 0.11 0.00 0.00 66.00 66.06 1pt7 h PRO 303 Cb 0.26 0.00 -0.31 0.00 0.11 0.00 0.00 31.00 31.05 1pt7 h PRO 303 CO -0.28 0.00 -0.88 -2.39 -0.21 0.00 0.00 178.00 174.24 1pt7 n HIS 304 N -2.38 1.07 0.21 0.65 1.44 -0.78 -4.88 115.22 110.56 1pt7 n HIS 304 Ca 0.01 -1.63 0.07 0.00 -2.01 0.00 0.00 57.72 54.16 1pt7 n HIS 304 Cb 0.18 -0.24 0.47 0.00 0.12 0.00 0.00 29.99 30.51 1pt7 n HIS 304 CO 0.00 0.00 0.00 0.97 -2.81 0.00 0.00 176.34 174.50 1pt7 h ILE 305 N 3.99 0.87 0.00 0.61 2.10 -0.98 -2.44 117.51 121.65 1pt7 h ILE 305 Ca 0.01 -1.11 -0.10 0.00 1.08 0.00 0.00 64.86 64.73 1pt7 h ILE 305 Cb 1.43 1.67 -0.01 0.00 -1.09 0.00 0.00 36.82 38.81 1pt7 h ILE 305 CO 0.27 0.28 -0.49 -0.26 -1.08 0.00 0.00 178.15 176.87 1pt7 h PHE 306 N 0.00 0.00 -0.79 2.19 0.04 -1.87 -0.64 116.94 115.86 1pt7 h PHE 306 Ca -0.00 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.73 1pt7 h PHE 306 Cb 0.64 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.76 1pt7 h PHE 306 CO 0.00 0.49 0.36 -0.44 -0.60 0.00 0.00 178.31 178.12 1pt7 h ASP 307 N 0.00 1.05 -0.30 2.17 3.32 -1.84 -0.70 116.42 120.12 1pt7 h ASP 307 Ca -0.00 -0.15 -0.08 0.00 0.02 0.00 0.00 57.03 56.82 1pt7 h ASP 307 Cb 1.36 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 40.64 1pt7 h ASP 307 CO 0.06 0.90 -0.13 0.40 -1.72 0.00 0.00 179.24 178.75 1pt7 h ILE 308 N 1.13 1.29 -0.75 0.35 2.04 -1.18 -1.11 117.51 119.28 1pt7 h ILE 308 Ca 0.27 -1.23 0.00 0.00 1.00 0.00 0.00 64.86 64.91 1pt7 h ILE 308 Cb 0.14 1.46 -0.04 0.00 -0.74 0.00 0.00 36.82 37.64 1pt7 h ILE 308 CO -0.03 0.39 0.48 -0.26 0.00 0.00 0.00 178.15 178.73 1pt7 h PHE 309 N 0.37 0.96 -0.58 1.37 0.04 -1.12 -1.09 116.94 116.89 1pt7 h PHE 309 Ca 0.07 0.01 -0.05 0.00 2.80 0.00 0.00 57.97 60.80 1pt7 h PHE 309 Cb 0.65 -0.32 -0.02 0.00 2.20 0.00 0.00 35.95 38.46 1pt7 h PHE 309 CO 0.06 0.62 0.15 0.00 -0.60 0.00 0.00 178.31 178.55 1pt7 h ALA 310 N 1.50 0.77 -0.65 2.45 0.00 -0.90 -0.05 119.26 122.39 1pt7 h ALA 310 Ca 0.27 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 1pt7 h ALA 310 Cb -0.08 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.45 1pt7 h ALA 310 CO -0.06 0.46 0.29 1.49 0.00 0.00 0.00 179.25 181.43 1pt7 h GLU 311 N 0.84 0.95 -0.60 0.00 4.57 -0.87 -2.26 114.58 117.21 1pt7 h GLU 311 Ca 0.18 -0.15 -0.08 0.00 -1.18 0.00 0.00 59.36 58.13 1pt7 h GLU 311 Cb 0.33 -0.16 -0.02 0.00 -0.16 0.00 0.00 28.75 28.73 1pt7 h GLU 311 CO -0.00 0.77 0.07 0.82 -1.18 0.00 0.00 179.01 179.50 1pt7 h ILE 312 N 0.90 1.25 0.00 2.32 2.04 -0.96 -2.24 117.51 120.82 1pt7 h ILE 312 Ca 0.22 -1.01 -0.01 0.00 1.00 0.00 0.00 64.86 65.06 1pt7 h ILE 312 Cb 0.16 0.72 -0.00 0.00 -0.74 0.00 0.00 36.82 36.96 1pt7 h ILE 312 CO -0.02 0.37 -0.02 -0.08 0.00 0.00 0.00 178.15 178.40 1pt7 h GLU 313 N 0.92 0.00 -0.46 2.37 4.81 -0.64 -0.68 114.58 120.90 1pt7 h GLU 313 Ca 0.18 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.41 1pt7 h GLU 313 Cb 0.44 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.79 1pt7 h GLU 313 CO 0.01 0.02 0.28 0.87 -0.73 0.00 0.00 179.01 179.47 1pt7 h LYS 314 N 0.00 0.61 0.09 1.92 1.57 -0.82 -1.11 116.57 118.83 1pt7 h LYS 314 Ca -0.00 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1pt7 h LYS 314 Cb 0.06 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.24 1pt7 h LYS 314 CO 0.00 0.42 -0.04 -0.92 -0.57 0.00 0.00 179.45 178.34 1pt7 h TYR 315 N 0.62 -0.12 -0.12 -1.35 3.20 -1.26 -3.39 116.97 114.56 1pt7 h TYR 315 Ca 0.17 -0.00 -0.05 0.00 3.14 0.00 0.00 58.73 61.98 1pt7 h TYR 315 Cb -0.04 0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.26 1pt7 h TYR 315 CO 0.00 0.41 -0.15 1.79 -1.64 0.00 0.00 178.16 178.57 1pt7 h THR 316 N -0.85 1.17 0.00 1.81 1.35 -0.97 -2.06 112.91 113.36 1pt7 h THR 316 Ca -0.01 -0.78 0.00 0.00 -0.55 0.00 0.00 66.41 65.06 1pt7 h THR 316 Cb 0.58 1.25 0.00 0.00 -1.73 0.00 0.00 68.15 68.25 1pt7 h THR 316 CO 0.02 0.24 0.00 -0.37 -0.25 0.00 0.00 175.52 175.16 1pt7 h VAL 317 N 0.18 0.00 -0.00 6.82 -1.51 -1.09 -2.97 116.25 117.68 1pt7 h VAL 317 Ca 0.04 -0.16 0.00 0.00 -1.23 0.00 0.00 66.70 65.35 1pt7 h VAL 317 Cb 0.38 1.00 0.00 0.00 -2.13 0.00 0.00 31.29 30.54 1pt7 h VAL 317 CO 0.02 0.00 -0.24 0.35 -1.23 0.00 0.00 177.57 176.47 1pt7 n THR 318 N -2.77 0.00 -4.09 7.19 -2.24 -0.77 -2.60 114.28 108.99 1pt7 n THR 318 Ca -0.01 -0.02 -0.09 0.00 -2.27 0.00 0.00 64.05 61.66 1pt7 n THR 318 Cb 0.14 -0.06 -0.10 0.00 -2.10 0.00 0.00 70.33 68.21 1pt7 n THR 318 CO 0.00 0.00 0.00 0.27 -0.57 0.00 0.00 175.07 174.77 1pt7 s ILE 319 N -2.86 0.35 0.51 2.28 -4.36 -1.13 -4.85 121.20 111.14 1pt7 s ILE 319 Ca 0.17 -1.65 -0.22 0.00 -0.26 0.00 0.00 60.65 58.68 1pt7 s ILE 319 Cb 0.19 -1.30 -0.06 0.00 1.25 0.00 0.00 42.46 42.53 1pt7 s ILE 319 CO 0.59 -0.84 1.26 -0.62 0.24 0.00 0.00 174.94 175.56 1pt7 s ASP 320 N -2.63 5.69 0.34 4.36 -1.08 -1.26 -1.04 116.67 121.05 1pt7 s ASP 320 Ca 0.04 2.53 0.09 0.00 -0.52 0.00 0.00 52.55 54.68 1pt7 s ASP 320 Cb 0.03 -2.62 0.81 0.00 -1.46 0.00 0.00 42.92 39.68 1pt7 s ASP 320 CO -0.06 -1.26 1.83 0.07 0.52 0.00 0.00 175.17 176.27 1pt7 h LYS 321 N 1.71 0.69 -0.59 4.34 2.10 -1.89 -0.70 116.57 122.22 1pt7 h LYS 321 Ca -0.50 -0.04 -0.09 0.00 -2.00 0.00 0.00 60.65 58.02 1pt7 h LYS 321 Cb 1.27 -0.15 -0.02 0.00 -0.90 0.00 0.00 32.23 32.43 1pt7 h LYS 321 CO 0.59 0.45 0.03 0.45 -2.00 0.00 0.00 179.45 178.97 1pt7 h HIS 322 N 0.71 1.09 -0.07 0.07 3.86 -1.94 -1.76 115.15 117.11 1pt7 h HIS 322 Ca 0.50 -0.17 -0.21 0.00 -1.16 0.00 0.00 60.37 59.33 1pt7 h HIS 322 Cb 0.83 -0.29 0.00 0.00 1.06 0.00 0.00 27.41 29.01 1pt7 h HIS 322 CO -0.00 0.95 -0.82 0.93 0.86 0.00 0.00 177.93 179.85 1pt7 h GLU 323 N 0.93 0.54 -0.43 2.45 5.08 -1.55 -1.53 114.58 120.07 1pt7 h GLU 323 Ca 0.17 -0.49 0.05 0.00 -1.00 0.00 0.00 59.36 58.10 1pt7 h GLU 323 Cb 0.50 0.11 -0.05 0.00 0.50 0.00 0.00 28.75 29.82 1pt7 h GLU 323 CO 0.02 1.11 0.15 0.00 -1.00 0.00 0.00 179.01 179.30 1pt7 h ALA 324 N 0.74 0.52 -0.37 3.43 0.00 -1.07 -1.70 119.26 120.80 1pt7 h ALA 324 Ca -0.06 0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.78 1pt7 h ALA 324 Cb 1.43 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.24 1pt7 h ALA 324 CO 0.15 -0.23 -0.24 0.28 0.00 0.00 0.00 179.25 179.21 1pt7 h VAL 325 N 0.32 1.28 -0.69 0.00 2.07 -1.17 0.42 116.25 118.48 1pt7 h VAL 325 Ca 0.20 -1.38 0.03 0.00 0.82 0.00 0.00 66.70 66.37 1pt7 h VAL 325 Cb 0.19 1.36 -0.04 0.00 -1.52 0.00 0.00 31.29 31.28 1pt7 h VAL 325 CO -0.20 0.46 0.45 0.00 0.02 0.00 0.00 177.57 178.30 1pt7 h ALA 326 N 0.79 1.61 0.15 1.67 0.00 -1.07 -0.81 119.26 121.60 1pt7 h ALA 326 Ca 0.08 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1pt7 h ALA 326 Cb 0.80 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1pt7 h ALA 326 CO 0.07 0.32 -0.07 -0.92 0.00 0.00 0.00 179.25 178.65 1pt7 h TYR 327 N 0.83 -0.19 -0.81 0.00 5.03 -1.10 -3.33 116.97 117.39 1pt7 h TYR 327 Ca 0.27 -0.00 0.07 0.00 2.58 0.00 0.00 58.73 61.65 1pt7 h TYR 327 Cb 0.06 0.06 -0.05 0.00 1.55 0.00 0.00 36.73 38.35 1pt7 h TYR 327 CO -0.00 0.03 0.53 -0.07 -1.32 0.00 0.00 178.16 177.33 1pt7 h LEU 328 N -1.02 0.77 -2.04 2.82 3.38 -0.82 -1.28 115.31 117.12 1pt7 h LEU 328 Ca -0.02 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 1pt7 h LEU 328 Cb 0.31 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 1pt7 h LEU 328 CO 0.03 0.49 -0.08 0.74 0.09 0.00 0.00 178.44 179.71 1pt7 h THR 329 N 0.87 0.71 0.00 0.22 2.02 -1.29 -1.11 112.91 114.34 1pt7 h THR 329 Ca 0.35 -0.34 -0.02 0.00 0.77 0.00 0.00 66.41 67.18 1pt7 h THR 329 Cb 0.26 1.20 -0.00 0.00 -1.74 0.00 0.00 68.15 67.87 1pt7 h THR 329 CO -0.13 0.08 -0.10 1.56 0.37 0.00 0.00 175.52 177.31 1pt7 h GLN 330 N 0.00 0.00 -0.69 6.66 4.20 -1.34 -1.31 115.11 122.63 1pt7 h GLN 330 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1pt7 h GLN 330 Cb 0.20 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.98 1pt7 h GLN 330 CO 0.01 0.10 0.00 1.19 -0.67 0.00 0.00 178.83 179.46 1pt7 n PHE 331 N -3.72 1.27 -1.55 2.96 3.01 -0.44 -4.89 117.46 114.09 1pt7 n PHE 331 Ca -0.02 -0.45 -0.19 0.00 1.01 0.00 0.00 57.45 57.80 1pt7 n PHE 331 Cb 0.21 -0.32 -0.08 0.00 -0.01 0.00 0.00 39.48 39.28 1pt7 n PHE 331 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 1pt7 n ASP 332 N 0.48 -5.33 -4.70 4.37 2.03 -0.49 -4.60 116.55 108.31 1pt7 n ASP 332 Ca 0.18 0.47 -0.42 0.00 0.52 0.00 0.00 54.79 55.54 1pt7 n ASP 332 Cb 0.81 -4.51 -0.03 0.00 -0.72 0.00 0.00 41.12 36.67 1pt7 n ASP 332 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1pt7 s ILE 333 N -2.70 4.83 -0.15 5.18 1.01 -1.10 -4.97 121.20 123.29 1pt7 s ILE 333 Ca 0.00 2.05 -0.29 0.00 0.00 0.00 0.00 60.65 62.40 1pt7 s ILE 333 Cb 0.00 -4.31 -0.02 0.00 0.01 0.00 0.00 42.46 38.13 1pt7 s ILE 333 CO 0.00 0.10 1.38 -2.84 0.00 0.00 0.00 174.94 173.58 1pt7 s PRO 334 N 1.41 4.18 0.18 2.79 0.02 -1.26 -4.23 135.00 138.10 1pt7 s PRO 334 Ca 0.51 1.77 -0.21 0.00 0.02 0.00 0.00 61.00 63.08 1pt7 s PRO 334 Cb -0.20 -3.84 0.05 0.00 0.02 0.00 0.00 34.50 30.53 1pt7 s PRO 334 CO 0.24 -0.80 0.59 0.00 -0.33 0.00 0.00 177.00 176.70 1pt7 s ALA 336 N -3.81 -1.26 0.48 0.00 0.00 -1.06 -4.99 121.76 111.13 1pt7 s ALA 336 Ca 0.04 0.19 -0.21 0.00 0.00 0.00 0.00 51.96 51.99 1pt7 s ALA 336 Cb -0.02 0.81 -0.08 0.00 0.00 0.00 0.00 23.12 23.83 1pt7 s ALA 336 CO -0.08 -0.73 1.05 -2.14 0.00 0.00 0.00 175.76 173.87 1pt7 s PRO 337 N -3.79 3.78 -0.75 0.00 0.02 -1.26 -1.45 135.00 131.55 1pt7 s PRO 337 Ca 0.03 1.42 -0.26 0.00 0.02 0.00 0.00 61.00 62.21 1pt7 s PRO 337 Cb 0.00 -2.14 -0.03 0.00 0.02 0.00 0.00 34.50 32.36 1pt7 s PRO 337 CO -0.11 -0.45 1.86 0.08 -0.33 0.00 0.00 177.00 178.04 1pt7 s VAL 338 N -1.91 3.43 0.04 3.83 1.01 -0.52 -4.80 120.40 121.48 1pt7 s VAL 338 Ca 0.67 -0.07 -0.30 0.00 0.00 0.00 0.00 61.98 62.28 1pt7 s VAL 338 Cb -0.18 -4.04 -0.04 0.00 0.00 0.00 0.00 36.38 32.11 1pt7 s VAL 338 CO 0.22 -1.00 0.97 -0.76 0.00 0.00 0.00 175.10 174.53 1pt7 s LEU 339 N 9.23 4.42 0.70 3.92 1.43 -1.26 -4.71 118.68 132.42 1pt7 s LEU 339 Ca 0.66 1.71 -0.11 0.00 -1.03 0.00 0.00 54.13 55.36 1pt7 s LEU 339 Cb -0.09 -3.57 0.01 0.00 0.03 0.00 0.00 46.19 42.56 1pt7 s LEU 339 CO 0.10 -0.18 1.08 -0.94 0.23 0.00 0.00 176.35 176.64 1pt7 s SER 340 N 0.61 5.42 0.51 2.29 1.04 -1.26 -4.89 113.70 117.42 1pt7 s SER 340 Ca 0.50 1.29 0.26 0.00 0.48 0.00 0.00 55.95 58.48 1pt7 s SER 340 Cb -0.22 -2.14 1.40 0.00 0.10 0.00 0.00 66.02 65.16 1pt7 s SER 340 CO 0.29 -1.38 2.06 0.24 0.98 0.00 0.00 173.24 175.43 1pt7 h MET 341 N -0.68 0.00 -0.09 4.02 0.00 -1.98 -1.34 114.93 114.86 1pt7 h MET 341 Ca -0.45 0.00 -0.02 0.00 0.00 0.00 0.00 59.70 59.23 1pt7 h MET 341 Cb 1.24 0.00 -0.00 0.00 0.00 0.00 0.00 31.60 32.83 1pt7 h MET 341 CO 0.62 0.13 -0.02 -0.22 0.00 0.00 0.00 176.91 177.41 1pt7 h LYS 342 N 0.00 0.17 -0.78 1.72 3.64 -1.99 0.05 116.57 119.39 1pt7 h LYS 342 Ca -0.00 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 1pt7 h LYS 342 Cb 0.33 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.11 1pt7 h LYS 342 CO 0.02 0.48 0.50 0.93 -2.27 0.00 0.00 179.45 179.11 1pt7 h GLU 343 N -0.15 1.03 -0.55 1.90 5.08 -1.83 -1.47 114.58 118.58 1pt7 h GLU 343 Ca 0.02 -0.07 -0.09 0.00 -1.00 0.00 0.00 59.36 58.22 1pt7 h GLU 343 Cb 0.42 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 1pt7 h GLU 343 CO 0.01 0.69 -0.01 0.82 -1.00 0.00 0.00 179.01 179.52 1pt7 h ILE 344 N 1.06 1.27 0.00 3.13 2.04 -1.18 -0.95 117.51 122.88 1pt7 h ILE 344 Ca 0.28 -1.14 -0.01 0.00 1.00 0.00 0.00 64.86 65.00 1pt7 h ILE 344 Cb -0.10 0.89 -0.00 0.00 -0.74 0.00 0.00 36.82 36.87 1pt7 h ILE 344 CO -0.06 0.41 -0.04 0.77 0.00 0.00 0.00 178.15 179.23 1pt7 h SER 345 N 0.87 0.00 -0.01 1.72 4.64 0.08 -2.92 113.55 117.93 1pt7 h SER 345 Ca 0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 1pt7 h SER 345 Cb 0.56 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.65 1pt7 h SER 345 CO 0.03 0.04 -0.07 0.18 -0.87 0.00 0.00 176.83 176.14 1pt7 n LEU 346 N -4.05 1.51 -4.63 5.97 4.77 -0.95 -5.00 117.00 114.62 1pt7 n LEU 346 Ca -0.03 -0.91 -0.43 0.00 -0.03 0.00 0.00 56.01 54.62 1pt7 n LEU 346 Cb 0.13 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.19 1pt7 n LEU 346 CO 0.31 0.30 1.51 -0.62 -1.33 0.00 0.00 177.39 177.55 1pt7 s ASP 347 N -0.95 6.19 0.39 -1.43 -1.08 -0.38 -4.88 116.67 114.52 1pt7 s ASP 347 Ca 0.09 1.82 0.09 0.00 -0.52 0.00 0.00 52.55 54.03 1pt7 s ASP 347 Cb 0.07 -2.53 0.79 0.00 -1.46 0.00 0.00 42.92 39.79 1pt7 s ASP 347 CO 0.15 -1.39 1.93 1.55 0.52 0.00 0.00 175.17 177.94 1pt7 h PRO 348 N 11.65 0.28 -0.87 4.34 0.13 -1.91 -2.18 132.00 143.44 1pt7 h PRO 348 Ca -0.38 -0.06 -0.01 0.00 -0.87 0.00 0.00 66.00 64.69 1pt7 h PRO 348 Cb 1.18 -0.04 -0.04 0.00 0.13 0.00 0.00 31.00 32.23 1pt7 h PRO 348 CO 0.99 0.38 0.50 1.03 -0.23 0.00 0.00 178.00 180.67 1pt7 h SER 349 N 0.27 1.05 0.97 1.44 0.87 -1.99 -1.08 113.55 115.08 1pt7 h SER 349 Ca 0.06 -0.07 -0.07 0.00 -1.23 0.00 0.00 61.79 60.47 1pt7 h SER 349 Cb 0.33 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 62.01 1pt7 h SER 349 CO 0.02 0.82 -0.33 -0.07 -0.53 0.00 0.00 176.83 176.74 1pt7 h LEU 350 N 1.20 0.00 -0.09 2.23 3.38 -1.76 -0.74 115.31 119.52 1pt7 h LEU 350 Ca 0.31 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.25 1pt7 h LEU 350 Cb -0.02 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.73 1pt7 h LEU 350 CO -0.06 0.33 -0.06 0.03 0.09 0.00 0.00 178.44 178.77 1pt7 h ARG 351 N 0.00 0.21 -0.77 1.13 2.47 -1.17 0.07 114.38 116.31 1pt7 h ARG 351 Ca -0.00 -0.10 -0.00 0.00 -1.26 0.00 0.00 59.98 58.62 1pt7 h ARG 351 Cb 0.90 -0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 29.18 1pt7 h ARG 351 CO 0.04 0.59 0.48 0.37 0.56 0.00 0.00 179.97 182.02 1pt7 h GLN 352 N -0.18 1.04 -0.00 0.04 4.15 -0.89 -2.12 115.11 117.15 1pt7 h GLN 352 Ca 0.02 -0.08 0.00 0.00 0.77 0.00 0.00 58.65 59.36 1pt7 h GLN 352 Cb 0.54 -0.22 0.00 0.00 0.21 0.00 0.00 27.48 28.01 1pt7 h GLN 352 CO 0.02 0.71 -0.04 -1.13 -1.93 0.00 0.00 178.83 176.46 1pt7 n SER 353 N -4.39 0.24 -0.27 -0.69 3.41 -0.31 -4.90 113.62 106.70 1pt7 n SER 353 Ca 0.08 -0.61 -0.04 0.00 -0.26 0.00 0.00 58.87 58.05 1pt7 n SER 353 Cb 0.05 -0.12 -0.02 0.00 -0.26 0.00 0.00 64.21 63.87 1pt7 n SER 353 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1pt7 n GLY 354 N 1.19 0.65 0.15 5.00 0.00 -0.80 -4.92 105.19 106.46 1pt7 n GLY 354 Ca 0.17 -0.60 -0.19 0.00 0.00 0.00 0.00 46.02 45.41 1pt7 n GLY 354 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1pt7 h SER 355 N 0.00 0.66 -3.31 1.61 0.02 -1.26 -3.36 113.55 107.92 1pt7 h SER 355 Ca -0.07 -0.63 -0.67 0.00 -0.84 0.00 0.00 61.79 59.57 1pt7 h SER 355 Cb 0.30 -0.21 -0.32 0.00 0.14 0.00 0.00 62.40 62.31 1pt7 h SER 355 CO 0.11 1.46 -0.85 -0.69 -1.14 0.00 0.00 176.83 175.71 1pt7 s VAL 356 N -2.91 2.28 -0.09 2.27 1.01 -0.73 -0.78 120.40 121.45 1pt7 s VAL 356 Ca -0.07 -0.93 0.02 0.00 0.00 0.00 0.00 61.98 61.00 1pt7 s VAL 356 Cb 0.07 -1.90 0.02 0.00 0.00 0.00 0.00 36.38 34.56 1pt7 s VAL 356 CO 0.91 0.55 -0.13 -0.69 0.00 0.00 0.00 175.10 175.74 1pt7 s VAL 357 N 0.47 1.25 -0.01 2.92 1.01 0.69 -4.04 120.40 122.70 1pt7 s VAL 357 Ca -0.14 -0.51 -0.29 0.00 0.00 0.00 0.00 61.98 61.04 1pt7 s VAL 357 Cb -0.17 -1.17 -0.03 0.00 0.00 0.00 0.00 36.38 35.01 1pt7 s VAL 357 CO 0.06 0.39 0.93 -0.70 0.00 0.00 0.00 175.10 175.78 1pt7 s GLU 358 N 0.98 4.54 -0.01 2.72 2.12 -1.26 -1.01 118.70 126.79 1pt7 s GLU 358 Ca -0.08 1.33 0.04 0.00 0.36 0.00 0.00 54.97 56.62 1pt7 s GLU 358 Cb -0.15 -3.45 -0.01 0.00 0.26 0.00 0.00 34.13 30.78 1pt7 s GLU 358 CO -0.01 -0.02 -0.12 0.08 -0.54 0.00 0.00 175.26 174.65 1pt7 s VAL 359 N 0.94 0.94 -0.18 3.70 1.01 0.11 -4.95 120.40 121.97 1pt7 s VAL 359 Ca 0.49 -0.52 -0.21 0.00 0.00 0.00 0.00 61.98 61.75 1pt7 s VAL 359 Cb -0.21 -0.79 -0.03 0.00 0.00 0.00 0.00 36.38 35.36 1pt7 s VAL 359 CO 0.26 0.26 0.62 -0.70 0.00 0.00 0.00 175.10 175.55 1pt7 s GLU 360 N -0.29 4.24 -0.07 2.72 2.56 -1.26 -0.52 118.70 126.08 1pt7 s GLU 360 Ca 0.05 0.62 0.05 0.00 0.00 0.00 0.00 54.97 55.69 1pt7 s GLU 360 Cb -0.05 -3.55 -0.01 0.00 2.00 0.00 0.00 34.13 32.53 1pt7 s GLU 360 CO -0.00 -0.17 -0.22 -1.14 -0.56 0.00 0.00 175.26 173.16 1pt7 s GLN 361 N 1.68 2.46 0.23 4.30 2.00 0.21 -4.13 119.66 126.42 1pt7 s GLN 361 Ca 0.29 -0.81 -0.31 0.00 -2.00 0.00 0.00 55.36 52.53 1pt7 s GLN 361 Cb -0.16 -2.03 -0.14 0.00 0.80 0.00 0.00 33.01 31.49 1pt7 s GLN 361 CO 0.11 0.29 1.38 -2.30 -0.50 0.00 0.00 175.29 174.27 1pt7 n PRO 362 N 3.17 1.93 0.00 1.67 -0.02 -1.26 -0.73 135.00 139.76 1pt7 n PRO 362 Ca -0.18 0.69 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 1pt7 n PRO 362 Cb 0.52 -2.33 0.00 0.00 -0.02 0.00 0.00 33.50 31.67 1pt7 n PRO 362 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1pt7 n LEU 363 N 2.16 0.00 -0.13 2.45 4.77 -1.26 -4.61 117.00 120.39 1pt7 n LEU 363 Ca 0.12 0.00 -0.24 0.00 -0.03 0.00 0.00 56.01 55.86 1pt7 n LEU 363 Cb 0.31 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.29 1pt7 n LEU 363 CO 0.62 0.00 -1.39 -1.14 -1.33 0.00 0.00 177.39 174.15 1pt7 n ARG 364 N -1.53 0.61 0.00 3.23 0.63 -1.04 -5.11 116.66 113.46 1pt7 n ARG 364 Ca 0.00 0.20 0.00 0.00 -0.92 0.00 0.00 57.85 57.13 1pt7 n ARG 364 Cb 0.00 -1.49 0.00 0.00 0.45 0.00 0.00 32.46 31.42 1pt7 n ARG 364 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1pt7 n GLY 365 N 1.76 0.49 3.76 5.14 0.00 0.09 -4.97 105.19 111.46 1pt7 n GLY 365 Ca -0.50 -1.46 -0.39 0.00 0.00 0.00 0.00 46.02 43.67 1pt7 n GLY 365 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pt7 s LYS 366 N 0.00 4.77 0.14 1.61 1.02 -1.26 -0.61 119.74 125.41 1pt7 s LYS 366 Ca 0.00 1.48 0.01 0.00 0.02 0.00 0.00 55.97 57.49 1pt7 s LYS 366 Cb 0.00 -3.16 -0.04 0.00 -0.52 0.00 0.00 37.83 34.10 1pt7 s LYS 366 CO 0.00 0.43 -0.00 1.52 -0.92 0.00 0.00 175.35 176.38 1pt7 s TYR 367 N -1.27 1.05 -0.14 3.18 -0.85 0.32 -4.93 117.35 114.71 1pt7 s TYR 367 Ca 0.43 -1.04 -0.10 0.00 -0.52 0.00 0.00 57.07 55.85 1pt7 s TYR 367 Cb -0.25 -0.60 -0.05 0.00 0.38 0.00 0.00 41.96 41.44 1pt7 s TYR 367 CO 0.31 -0.26 0.19 -0.51 -1.52 0.00 0.00 175.55 173.76 1pt7 s LEU 368 N -3.11 4.32 0.24 -3.49 1.43 -1.26 0.05 118.68 116.86 1pt7 s LEU 368 Ca 0.21 0.45 0.05 0.00 -1.03 0.00 0.00 54.13 53.81 1pt7 s LEU 368 Cb 0.06 -2.18 -0.05 0.00 0.03 0.00 0.00 46.19 44.05 1pt7 s LEU 368 CO 0.01 0.28 -0.03 0.28 0.23 0.00 0.00 176.35 177.12 1pt7 s THR 369 N -0.34 1.27 -0.03 5.49 -1.32 -0.18 -4.91 115.64 115.62 1pt7 s THR 369 Ca 0.14 -2.07 -0.30 0.00 -1.21 0.00 0.00 61.69 58.25 1pt7 s THR 369 Cb -0.12 -2.35 -0.03 0.00 -1.51 0.00 0.00 72.50 68.49 1pt7 s THR 369 CO 0.03 -0.34 1.05 -0.69 -2.21 0.00 0.00 174.62 172.45 1pt7 s VAL 370 N -3.26 4.66 0.00 5.08 1.01 -1.26 -0.22 120.40 126.40 1pt7 s VAL 370 Ca 0.28 1.92 0.00 0.00 0.00 0.00 0.00 61.98 64.18 1pt7 s VAL 370 Cb 0.05 -4.23 0.00 0.00 0.00 0.00 0.00 36.38 32.20 1pt7 s VAL 370 CO 0.09 0.08 0.00 0.61 0.00 0.00 0.00 175.10 175.88 1pt7 n GLY 371 N 3.07 -0.47 3.62 4.51 0.00 0.04 -4.88 105.19 111.07 1pt7 n GLY 371 Ca 0.08 -1.73 -0.43 0.00 0.00 0.00 0.00 46.02 43.94 1pt7 n GLY 371 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pt7 h PRO 373 N 10.70 0.96 -6.24 0.00 0.13 -1.93 -3.43 132.00 132.20 1pt7 h PRO 373 Ca -0.31 -0.23 -0.57 0.00 -0.87 0.00 0.00 66.00 64.02 1pt7 h PRO 373 Cb 1.13 -0.12 -0.04 0.00 0.13 0.00 0.00 31.00 32.10 1pt7 h PRO 373 CO 1.03 0.89 -0.17 0.00 -0.23 0.00 0.00 178.00 179.51 1pt7 s MET 374 N -5.29 3.84 -0.09 0.86 0.23 -1.26 -5.02 119.30 112.56 1pt7 s MET 374 Ca -0.12 0.29 -0.03 0.00 -1.03 0.00 0.00 55.69 54.80 1pt7 s MET 374 Cb 0.13 -2.92 -0.03 0.00 -1.53 0.00 0.00 34.83 30.48 1pt7 s MET 374 CO 0.82 0.49 0.02 0.15 -2.03 0.00 0.00 175.02 174.48 1pt7 s LYS 375 N -2.09 3.09 -0.08 3.16 -0.14 -1.26 -5.07 119.74 117.36 1pt7 s LYS 375 Ca 0.37 -0.36 0.05 0.00 -1.36 0.00 0.00 55.97 54.66 1pt7 s LYS 375 Cb -0.14 -2.87 -0.01 0.00 -1.68 0.00 0.00 37.83 33.13 1pt7 s LYS 375 CO 0.19 0.69 -0.23 -0.06 -0.76 0.00 0.00 175.35 175.19 1pt7 s PHE 376 N -0.85 2.54 -0.40 3.18 0.40 -1.26 -5.02 117.98 116.57 1pt7 s PHE 376 Ca 0.13 -0.76 0.27 0.00 -0.60 0.00 0.00 56.93 55.96 1pt7 s PHE 376 Cb -0.11 -1.66 0.85 0.00 0.51 0.00 0.00 43.02 42.61 1pt7 s PHE 376 CO 0.02 -0.24 1.77 0.66 0.70 0.00 0.00 175.22 178.13 1pt7 h SER 377 N 6.27 0.00 -0.35 1.36 4.64 -2.06 -3.19 113.55 120.21 1pt7 h SER 377 Ca -0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 1pt7 h SER 377 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1pt7 h SER 377 CO 0.48 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.44 1pt7 n ALA 378 N -1.94 2.24 -3.64 5.18 0.00 -1.26 -4.98 120.51 116.11 1pt7 n ALA 378 Ca 0.03 -1.09 -0.08 0.00 0.00 0.00 0.00 53.44 52.30 1pt7 n ALA 378 Cb 0.38 -0.50 -0.07 0.00 0.00 0.00 0.00 19.45 19.26 1pt7 n ALA 378 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1pt7 s PHE 379 N -1.01 -1.02 -0.25 0.00 5.99 -1.21 -4.92 117.98 115.57 1pt7 s PHE 379 Ca 0.26 2.09 0.02 0.00 0.00 0.00 0.00 56.93 59.29 1pt7 s PHE 379 Cb 0.14 0.58 0.06 0.00 0.00 0.00 0.00 43.02 43.79 1pt7 s PHE 379 CO 0.18 -0.50 -0.09 0.99 -0.00 0.00 0.00 175.22 175.80 1pt7 s THR 380 N 1.45 1.91 0.69 0.12 2.01 -1.26 -4.17 115.64 116.39 1pt7 s THR 380 Ca -0.09 -1.47 -0.16 0.00 0.31 0.00 0.00 61.69 60.28 1pt7 s THR 380 Cb -0.05 -2.08 0.01 0.00 0.01 0.00 0.00 72.50 70.39 1pt7 s THR 380 CO -0.17 -0.06 1.24 -2.16 -0.69 0.00 0.00 174.62 172.78 1pt7 s PRO 381 N 1.22 2.36 -0.32 4.92 0.04 -1.26 -5.00 135.00 136.95 1pt7 s PRO 381 Ca -0.08 1.87 0.04 0.00 0.04 0.00 0.00 61.00 62.87 1pt7 s PRO 381 Cb -0.20 -1.85 0.09 0.00 0.04 0.00 0.00 34.50 32.59 1pt7 s PRO 381 CO -0.05 -1.70 0.01 0.34 0.04 0.00 0.00 177.00 175.64 1pt7 s ASP 382 N -1.76 4.66 -0.16 6.66 2.15 -1.26 -5.09 116.67 121.86 1pt7 s ASP 382 Ca 0.77 -1.94 -0.21 0.00 0.43 0.00 0.00 52.55 51.60 1pt7 s ASP 382 Cb -0.32 -1.58 -0.03 0.00 -0.30 0.00 0.00 42.92 40.69 1pt7 s ASP 382 CO 0.42 -0.33 0.65 -0.63 -0.17 0.00 0.00 175.17 175.11 1pt7 s ILE 383 N 0.98 5.03 0.48 4.11 1.01 -1.26 -4.98 121.20 126.56 1pt7 s ILE 383 Ca 0.06 1.25 0.02 0.00 0.00 0.00 0.00 60.65 61.98 1pt7 s ILE 383 Cb -0.19 -3.97 -0.03 0.00 0.01 0.00 0.00 42.46 38.28 1pt7 s ILE 383 CO -0.08 0.15 0.02 -0.54 0.00 0.00 0.00 174.94 174.49 1pt7 s LYS 384 N 1.62 2.13 0.92 2.79 1.02 -1.26 -4.91 119.74 122.05 1pt7 s LYS 384 Ca 0.31 -2.33 -0.10 0.00 0.02 0.00 0.00 55.97 53.87 1pt7 s LYS 384 Cb -0.16 -1.46 0.15 0.00 -0.52 0.00 0.00 37.83 35.84 1pt7 s LYS 384 CO 0.12 -0.32 1.14 0.00 -0.92 0.00 0.00 175.35 175.37 1pt7 s ALA 385 N -2.89 1.42 0.29 5.17 0.00 -1.26 -3.72 121.76 120.78 1pt7 s ALA 385 Ca 0.12 0.56 -0.17 0.00 0.00 0.00 0.00 51.96 52.48 1pt7 s ALA 385 Cb 0.03 -3.44 -0.09 0.00 0.00 0.00 0.00 23.12 19.62 1pt7 s ALA 385 CO 0.06 -2.79 0.74 0.00 0.00 0.00 0.00 175.76 173.78 1pt7 s ALA 386 N -2.65 3.34 0.34 0.00 0.00 -1.26 -1.43 121.76 120.10 1pt7 s ALA 386 Ca 0.67 0.09 -0.27 0.00 0.00 0.00 0.00 51.96 52.44 1pt7 s ALA 386 Cb -0.23 -2.79 -0.09 0.00 0.00 0.00 0.00 23.12 20.01 1pt7 s ALA 386 CO 0.58 0.33 1.11 -1.25 0.00 0.00 0.00 175.76 176.53 1pt7 s PRO 387 N -2.67 4.38 0.66 0.00 0.04 -1.26 -4.89 135.00 131.25 1pt7 s PRO 387 Ca 0.51 1.76 -0.14 0.00 0.04 0.00 0.00 61.00 63.17 1pt7 s PRO 387 Cb -0.12 -2.91 -0.00 0.00 0.04 0.00 0.00 34.50 31.51 1pt7 s PRO 387 CO 0.18 -0.01 1.08 -0.51 0.04 0.00 0.00 177.00 177.78 1pt7 s LEU 388 N -1.99 3.32 0.08 -3.56 1.43 -1.26 -4.91 118.68 111.79 1pt7 s LEU 388 Ca 0.51 1.83 -0.31 0.00 -1.03 0.00 0.00 54.13 55.13 1pt7 s LEU 388 Cb -0.29 -4.53 -0.09 0.00 0.03 0.00 0.00 46.19 41.31 1pt7 s LEU 388 CO 0.38 -1.49 1.72 -0.22 0.23 0.00 0.00 176.35 176.97 1pt7 s LEU 389 N -5.02 4.38 -0.63 1.79 0.20 -1.26 -1.32 118.68 116.81 1pt7 s LEU 389 Ca 0.63 2.56 0.00 0.00 0.69 0.00 0.00 54.13 58.01 1pt7 s LEU 389 Cb -0.17 -3.56 0.00 0.00 -0.43 0.00 0.00 46.19 42.03 1pt7 s LEU 389 CO 0.45 -0.93 0.00 0.61 -0.29 0.00 0.00 176.35 176.18 1pt7 n GLY 390 N 4.10 0.77 0.33 7.98 0.00 -1.25 -4.92 105.19 112.20 1pt7 n GLY 390 Ca 0.17 -0.27 0.07 0.00 0.00 0.00 0.00 46.02 45.99 1pt7 n GLY 390 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1pt7 h GLU 391 N 0.22 0.51 -0.26 1.61 4.81 -1.09 -2.55 114.58 117.84 1pt7 h GLU 391 Ca -0.12 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.08 1pt7 h GLU 391 Cb 0.64 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.90 1pt7 h GLU 391 CO 0.18 0.34 0.00 0.72 -0.73 0.00 0.00 179.01 179.52 1pt7 n HIS 392 N -4.47 0.34 -0.06 0.92 8.25 -0.41 -4.74 115.22 115.04 1pt7 n HIS 392 Ca 0.07 -0.48 -0.08 0.00 -0.26 0.00 0.00 57.72 56.97 1pt7 n HIS 392 Cb 0.21 -0.03 -0.01 0.00 1.12 0.00 0.00 29.99 31.27 1pt7 n HIS 392 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 1pt7 h THR 393 N 1.56 0.46 0.08 1.59 2.02 -1.23 -0.89 112.91 116.51 1pt7 h THR 393 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1pt7 h THR 393 Cb 0.66 0.46 -0.01 0.00 -1.74 0.00 0.00 68.15 67.53 1pt7 h THR 393 CO 0.00 0.00 -0.07 0.00 0.37 0.00 0.00 175.52 175.82 1pt7 h ALA 394 N 0.94 -0.14 -0.57 6.16 0.00 -1.85 -1.42 119.26 122.37 1pt7 h ALA 394 Ca 0.14 -0.02 0.07 0.00 0.00 0.00 0.00 54.91 55.10 1pt7 h ALA 394 Cb 0.41 0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.24 1pt7 h ALA 394 CO -0.37 -0.59 0.26 0.00 0.00 0.00 0.00 179.25 178.55 1pt7 h ALA 395 N 0.75 0.74 -0.63 0.00 0.00 -1.84 0.15 119.26 118.42 1pt7 h ALA 395 Ca -0.00 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 1pt7 h ALA 395 Cb 0.15 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 1pt7 h ALA 395 CO -0.01 -0.11 0.21 0.28 0.00 0.00 0.00 179.25 179.62 1pt7 h VAL 396 N 0.49 1.24 -0.35 0.00 2.07 -0.92 -1.02 116.25 117.75 1pt7 h VAL 396 Ca 0.27 -0.81 -0.13 0.00 0.82 0.00 0.00 66.70 66.84 1pt7 h VAL 396 Cb 0.24 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 30.58 1pt7 h VAL 396 CO -0.22 0.31 -0.31 -0.07 0.02 0.00 0.00 177.57 177.31 1pt7 h LEU 397 N 0.90 0.79 -0.81 2.57 3.38 -0.73 -1.77 115.31 119.65 1pt7 h LEU 397 Ca 0.21 -0.32 0.04 0.00 0.09 0.00 0.00 57.88 57.89 1pt7 h LEU 397 Cb 0.27 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 40.75 1pt7 h LEU 397 CO -0.01 1.04 0.51 1.56 0.09 0.00 0.00 178.44 181.64 1pt7 h GLN 398 N 0.65 0.95 0.00 1.13 4.20 -0.46 -1.69 115.11 119.88 1pt7 h GLN 398 Ca 0.07 -0.06 -0.06 0.00 0.06 0.00 0.00 58.65 58.67 1pt7 h GLN 398 Cb 0.84 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 28.40 1pt7 h GLN 398 CO 0.07 0.63 -0.29 0.93 -0.67 0.00 0.00 178.83 179.50 1pt7 h GLU 399 N 0.97 0.00 -0.00 1.46 5.08 -0.77 -0.54 114.58 120.79 1pt7 h GLU 399 Ca 0.34 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.70 1pt7 h GLU 399 Cb 0.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.32 1pt7 h GLU 399 CO -0.13 0.29 -0.00 1.28 -1.00 0.00 0.00 179.01 179.44 1pt7 n LEU 400 N -4.09 0.04 0.00 1.33 4.77 -0.71 -4.92 117.00 113.43 1pt7 n LEU 400 Ca -0.02 0.07 0.00 0.00 -0.03 0.00 0.00 56.01 56.03 1pt7 n LEU 400 Cb 0.34 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.35 1pt7 n LEU 400 CO 0.37 0.01 0.00 0.61 -1.33 0.00 0.00 177.39 177.05 1pt7 n GLY 401 N 1.09 0.87 3.76 -0.72 0.00 -0.21 -5.07 105.19 104.91 1pt7 n GLY 401 Ca 0.21 -0.06 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 1pt7 n GLY 401 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1pt7 s TYR 402 N -2.00 3.61 0.72 1.61 1.51 -0.75 -5.00 117.35 117.06 1pt7 s TYR 402 Ca 0.00 1.74 -0.11 0.00 -1.01 0.00 0.00 57.07 57.69 1pt7 s TYR 402 Cb 0.00 -3.15 0.02 0.00 -0.11 0.00 0.00 41.96 38.72 1pt7 s TYR 402 CO 0.00 -0.28 1.07 -1.54 -1.11 0.00 0.00 175.55 173.69 1pt7 s SER 403 N -1.15 5.19 0.52 2.29 1.04 -1.26 -4.29 113.70 116.03 1pt7 s SER 403 Ca 0.47 1.56 0.17 0.00 0.48 0.00 0.00 55.95 58.63 1pt7 s SER 403 Cb -0.27 -2.40 1.27 0.00 0.10 0.00 0.00 66.02 64.71 1pt7 s SER 403 CO 0.35 -1.56 2.12 0.44 0.98 0.00 0.00 173.24 175.57 1pt7 h ASP 404 N -0.80 0.03 0.13 7.02 3.32 -1.99 -0.87 116.42 123.26 1pt7 h ASP 404 Ca -0.44 -0.00 -0.25 0.00 0.02 0.00 0.00 57.03 56.36 1pt7 h ASP 404 Cb 1.22 -0.01 0.01 0.00 0.22 0.00 0.00 39.33 40.78 1pt7 h ASP 404 CO 0.57 0.02 -0.98 0.44 -1.72 0.00 0.00 179.24 177.57 1pt7 h ASP 405 N 0.03 0.75 -0.62 6.45 3.32 -1.99 -1.74 116.42 122.62 1pt7 h ASP 405 Ca 0.05 -0.59 -0.04 0.00 0.02 0.00 0.00 57.03 56.46 1pt7 h ASP 405 Cb 0.15 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.44 1pt7 h ASP 405 CO -0.00 1.39 0.24 -0.33 -1.72 0.00 0.00 179.24 178.82 1pt7 h GLU 406 N 0.34 0.96 -0.23 3.56 5.08 -1.78 -1.11 114.58 121.41 1pt7 h GLU 406 Ca -0.10 -0.17 -0.04 0.00 -1.00 0.00 0.00 59.36 58.05 1pt7 h GLU 406 Cb 1.62 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 30.70 1pt7 h GLU 406 CO 0.18 0.80 -0.03 0.82 -1.00 0.00 0.00 179.01 179.78 1pt7 h ILE 407 N 0.94 1.27 -0.64 3.13 2.04 -1.11 -1.32 117.51 121.82 1pt7 h ILE 407 Ca 0.22 -0.97 -0.03 0.00 1.00 0.00 0.00 64.86 65.08 1pt7 h ILE 407 Cb 0.21 1.45 -0.03 0.00 -0.74 0.00 0.00 36.82 37.71 1pt7 h ILE 407 CO -0.02 0.30 0.30 0.00 0.00 0.00 0.00 178.15 178.73 1pt7 h ALA 408 N 0.78 1.31 -0.21 1.87 0.00 -1.07 -0.77 119.26 121.18 1pt7 h ALA 408 Ca 0.06 -0.14 -0.12 0.00 0.00 0.00 0.00 54.91 54.71 1pt7 h ALA 408 Cb 0.46 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1pt7 h ALA 408 CO 0.02 0.53 -0.40 0.00 0.00 0.00 0.00 179.25 179.40 1pt7 h ALA 409 N 1.42 0.93 -0.20 0.00 0.00 -1.02 -1.14 119.26 119.25 1pt7 h ALA 409 Ca 0.22 -0.43 -0.14 0.00 0.00 0.00 0.00 54.91 54.56 1pt7 h ALA 409 Cb 0.11 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1pt7 h ALA 409 CO -0.03 0.63 -0.48 0.52 0.00 0.00 0.00 179.25 179.89 1pt7 h MET 410 N 0.39 0.52 -0.10 0.00 2.07 -0.31 -1.55 114.93 115.96 1pt7 h MET 410 Ca 0.04 -0.30 -0.00 0.00 -2.07 0.00 0.00 59.70 57.37 1pt7 h MET 410 Cb 0.87 0.02 -0.00 0.00 -1.87 0.00 0.00 31.60 30.62 1pt7 h MET 410 CO 0.07 0.89 0.06 -0.22 1.07 0.00 0.00 176.91 178.78 1pt7 h LYS 411 N 0.42 0.14 -0.57 1.72 3.11 -0.82 -1.99 116.57 118.57 1pt7 h LYS 411 Ca 0.02 -0.01 -0.04 0.00 -2.81 0.00 0.00 60.65 57.80 1pt7 h LYS 411 Cb 1.00 -0.03 -0.03 0.00 -1.00 0.00 0.00 32.23 32.17 1pt7 h LYS 411 CO 0.09 0.14 0.17 0.37 -2.81 0.00 0.00 179.45 177.41 1pt7 h GLN 412 N 0.09 0.85 -0.49 1.90 4.15 -1.10 -2.56 115.11 117.95 1pt7 h GLN 412 Ca 0.04 -0.16 0.00 0.00 0.77 0.00 0.00 58.65 59.30 1pt7 h GLN 412 Cb 0.04 -0.14 0.00 0.00 0.21 0.00 0.00 27.48 27.59 1pt7 h GLN 412 CO -0.01 0.74 0.00 0.27 -1.93 0.00 0.00 178.83 177.90 1pt7 n ASN 413 N -4.29 2.63 -0.34 -0.69 0.23 -0.59 -4.95 115.26 107.26 1pt7 n ASN 413 Ca 0.04 -2.04 -0.04 0.00 -0.53 0.00 0.00 54.58 52.01 1pt7 n ASN 413 Cb 0.20 -0.34 -0.02 0.00 -2.08 0.00 0.00 39.78 37.55 1pt7 n ASN 413 CO 0.00 0.00 0.00 1.41 -0.93 0.00 0.00 177.26 177.74 1pt7 n HIS 414 N 0.85 0.00 0.25 -2.53 8.25 -0.94 -4.87 115.22 116.23 1pt7 n HIS 414 Ca 0.16 0.00 0.09 0.00 -0.26 0.00 0.00 57.72 57.71 1pt7 n HIS 414 Cb 0.43 -1.33 0.63 0.00 1.12 0.00 0.00 29.99 30.84 1pt7 n HIS 414 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1pt7 h ALA 415 N 0.00 1.54 0.00 -1.41 0.00 -1.65 -3.42 119.26 114.32 1pt7 h ALA 415 Ca -0.09 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1pt7 h ALA 415 Cb 0.52 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1pt7 h ALA 415 CO 0.13 0.17 0.00 0.44 0.00 0.00 0.00 179.25 179.99